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

Systemtic Name: 2-methoxy-1-[3-(2-methylphenyl)carbonyl-4-(3-methylthiophen-2-yl)-2-(3-nitrophenyl)-5-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 2-methoxy-1-[3-(2-methylbenzoyl)-4-(3-methyl-2-thienyl)-2-(3-nitrophenyl)-5-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 2-methoxy-1-[3-[(2-methylphenyl)-oxomethyl]-4-(3-methyl-2-thiophenyl)-2-(3-nitrophenyl)-5-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]ethanone IUPAC Name: 2-methoxy-1-[3-(2-methylbenzoyl)-4-(3-methylthiophen-2-yl)-2-(3-nitrophenyl)-5-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-methoxy-1-[4-(3-methyl-2-thienyl)-2-(3-nitrophenyl)-3-o-toluoyl-5-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C31H34N4O6S MolecularWeight: 590.68986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)COC)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)COC)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C31H34N4O6S/c1-19-7-4-5-10-23(19)29(37)25-26(30-20(2)11-16-42-30)28(31(38)33-14-12-32-13-15-33)34(24(36)18-41-3)27(25)21-8-6-9-22(17-21)35(39)40/h4-11,16-17,25-28,32H,12-15,18H2,1-3H3