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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C18H19N3O3S3 MolecularWeight: 421.55676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N3O3S3/c1-12-8-9-16(25-12)27(23,24)21-10-4-5-13(11-21)17(22)20-18-19-14-6-2-3-7-15(14)26-18/h2-3,6-9,13H,4-5,10-11H2,1H3,(H,19,20,22)