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Tert-Butyl N-[6-(N,N-dipropyl-carbamo-yl)-1,3-benzothia-zol-2-yl]carbamate.

ABSTRACT: The title compound C(19)H(27)N(3)O(3)S, crystallizes with two unique mol-ecules in the asymmetric unit. The benzene ring of each benzothia-zole unit carries a dipropyl-carbamoyl substituent in the 6-position and a tert-butyl carbamate unit on each thia-zole ring. In the crystal structure, inter-molecular N-H?N and weak C-H?O hydrogen bonds form centrosymmetric dimers. Additional C-H?O contacts construct a three-dimensional network. A very weak C-H?? contact is also present.

SUBMITTER: Fang X

PROVIDER: S-EPMC2979059 | biostudies-literature | 2010 Apr

REPOSITORIES: biostudies-literature

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tert-Butyl N-[6-(N,N-dipropyl-carbamo-yl)-1,3-benzothia-zol-2-yl]carbamate.

Fang Xin X Lei Can C Yu Hai-Yang HY Huang Ming-Dong MD Wang Jun-Dong JD

Acta crystallographica. Section E, Structure reports online 20100430 Pt 5

The title compound C(19)H(27)N(3)O(3)S, crystallizes with two unique mol-ecules in the asymmetric unit. The benzene ring of each benzothia-zole unit carries a dipropyl-carbamoyl substituent in the 6-position and a tert-butyl carbamate unit on each thia-zole ring. In the crystal structure, inter-molecular N-H⋯N and weak C-H⋯O hydrogen bonds form centrosymmetric dimers. Additional C-H⋯O contacts construct a three-dimensional network. A very weak C-H⋯π contact is also present. ...[more]

PMID: 21579259

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