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

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H23N3O3S3/c1-14-9-10-19(27-14)29(25,26)23-11-5-6-15(12-23)20(24)22(2)13-18-21-16-7-3-4-8-17(16)28-18/h3-4,7-10,15H,5-6,11-13H2,1-2H3