N-[1-(2-phenylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-(2-phenylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(2-phenylsulfanylpyridine-3-carbonyl)-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[oxo-[2-(phenylthio)-3-pyridinyl]methyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-(2-phenylsulfanylpyridine-3-carbonyl)piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-[2-(phenylthio)nicotinoyl]-4-piperidyl]thiophene-2-sulfonamide Formula: C21H21N3O3S3 MolecularWeight: 459.60474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=CS2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=CS2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S3/c25-21(18-8-4-12-22-20(18)29-17-6-2-1-3-7-17)24-13-10-16(11-14-24)23-30(26,27)19-9-5-15-28-19/h1-9,12,15-16,23H,10-11,13-14H2