N-[1-(4-methylphenyl)sulfonyl-2-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[1-(4-methylphenyl)sulfonyl-2-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(4-nitrobenzoyl)piperazin-1-yl]-2-oxo-1-(p-tolylsulfonyl)ethyl]thiophene-2-carboxamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-2-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(4-methylphenyl)sulfonyl-2-[4-(4-nitrobenzoyl)piperazin-1-yl]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-keto-2-[4-(4-nitrobenzoyl)piperazino]-1-tosyl-ethyl]thiophene-2-carboxamide Formula: C25H24N4O7S2 MolecularWeight: 556.61066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC=CS4

InChI

InChI=1S/C25H24N4O7S2/c1-17-4-10-20(11-5-17)38(35,36)23(26-22(30)21-3-2-16-37-21)25(32)28-14-12-27(13-15-28)24(31)18-6-8-19(9-7-18)29(33)34/h2-11,16,23H,12-15H2,1H3,(H,26,30)