(2S)-N-(1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: (2S)-N-(1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-2-carboxamide Openeye Name: (2S)-N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]piperidine-2-carboxamide CAS Name: (2S)-N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-piperidinecarboxamide IUPAC Name: (2S)-N-(1,3-benzothiazol-2-yl)-1-(5-chlorothiophen-2-yl)sulfonylpiperidine-2-carboxamide Traditional Name: (2S)-N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]pipecolinamide Formula: C17H16ClN3O3S3 MolecularWeight: 441.97524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)NC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H16ClN3O3S3/c18-14-8-9-15(26-14)27(23,24)21-10-4-3-6-12(21)16(22)20-17-19-11-5-1-2-7-13(11)25-17/h1-2,5,7-9,12H,3-4,6,10H2,(H,19,20,22)/t12-/m0/s1