N-[1-[(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[oxo-[2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)-4-piperidyl]thiophene-2-sulfonamide Formula: C22H25N3O3S3 MolecularWeight: 475.6472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)N4CCC(CC4)NS(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)N4CCC(CC4)NS(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H25N3O3S3/c26-21(20-17-6-1-2-7-18(17)30-22(20)25-11-3-4-12-25)24-13-9-16(10-14-24)23-31(27,28)19-8-5-15-29-19/h3-5,8,11-12,15-16,23H,1-2,6-7,9-10,13-14H2