2-methoxy-1-[2-(4-methylphenyl)-3-(4-nitrophenyl)carbonyl-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidin-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[2-(4-methylphenyl)-3-(4-nitrophenyl)carbonyl-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidin-1-yl]ethanone Openeye Name: 2-methoxy-1-[4-(4-nitrobenzoyl)-2-(piperazine-1-carbonyl)-5-(p-tolyl)-3-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-methoxy-1-[2-(4-methylphenyl)-3-[(4-nitrophenyl)-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-4-thiophen-2-yl-1-pyrrolidinyl]ethanone IUPAC Name: 2-methoxy-1-[2-(4-methylphenyl)-3-(4-nitrobenzoyl)-5-(piperazine-1-carbonyl)-4-thiophen-2-ylpyrrolidin-1-yl]ethanone Traditional Name: 2-methoxy-1-[4-(4-nitrobenzoyl)-2-(piperazine-1-carbonyl)-5-(p-tolyl)-3-(2-thienyl)pyrrolidino]ethanone Formula: C30H32N4O6S MolecularWeight: 576.66328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)COC)C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)COC)C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H32N4O6S/c1-19-5-7-20(8-6-19)27-26(29(36)21-9-11-22(12-10-21)34(38)39)25(23-4-3-17-41-23)28(33(27)24(35)18-40-2)30(37)32-15-13-31-14-16-32/h3-12,17,25-28,31H,13-16,18H2,1-2H3