N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(4-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(4-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(4-cyanophenyl)sulfonyl-isonipecotamide Formula: C20H17ClN4O3S2 MolecularWeight: 460.95698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H17ClN4O3S2/c21-15-3-6-17-18(11-15)29-20(23-17)24-19(26)14-7-9-25(10-8-14)30(27,28)16-4-1-13(12-22)2-5-16/h1-6,11,14H,7-10H2,(H,23,24,26)