N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-(4-tosylpiperazino)ethyl]thiophene-2-carboxamide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C25H27N3O4S2/c1-19-9-11-21(12-10-19)34(31,32)28-15-13-27(14-16-28)25(30)22(18-20-6-3-2-4-7-20)26-24(29)23-8-5-17-33-23/h2-12,17,22H,13-16,18H2,1H3,(H,26,29)/t22-/m0/s1