(3S)-N-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(4-tert-butylthiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: (3S)-N-(4-tert-butyl-2-thiazolyl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5-chlorothiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(4-tert-butylthiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]nipecotamide Formula: C17H22ClN3O3S3 MolecularWeight: 448.02288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H22ClN3O3S3/c1-17(2,3)12-10-25-16(19-12)20-15(22)11-5-4-8-21(9-11)27(23,24)14-7-6-13(18)26-14/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,19,20,22)/t11-/m0/s1