N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-2-oxo-1-phenylethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-oxo-1-phenylethyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazino]-2-keto-1-phenyl-ethyl]thiophene-2-carboxamide Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H30N4O4S2/c28-22(20-11-8-18-32-20)24-21(19-9-4-3-5-10-19)23(29)25-14-16-27(17-15-25)33(30,31)26-12-6-1-2-7-13-26/h3-5,8-11,18,21H,1-2,6-7,12-17H2,(H,24,28)