(2-methylphenyl)-[4-(3-methylthiophen-2-yl)-2-(3-nitrophenyl)-5-piperazin-1-ylcarbonyl-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl]methanone

Systemtic Name: (2-methylphenyl)-[4-(3-methylthiophen-2-yl)-2-(3-nitrophenyl)-5-piperazin-1-ylcarbonyl-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl]methanone Openeye Name: [4-(3-methyl-2-thienyl)-2-(3-nitrophenyl)-5-(piperazine-1-carbonyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]-(o-tolyl)methanone CAS Name: (2-methylphenyl)-[4-(3-methyl-2-thiophenyl)-2-(3-nitrophenyl)-5-[oxo(1-piperazinyl)methyl]-1-[oxo(thiophen-2-yl)methyl]-3-pyrrolidinyl]methanone IUPAC Name: (2-methylphenyl)-[4-(3-methylthiophen-2-yl)-2-(3-nitrophenyl)-5-(piperazine-1-carbonyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]methanone Traditional Name: [4-(3-methyl-2-thienyl)-2-(3-nitrophenyl)-5-(piperazine-1-carbonyl)-1-(2-thenoyl)pyrrolidin-3-yl]-(o-tolyl)methanone Formula: C33H32N4O5S2 MolecularWeight: 628.76098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4=CC=CS4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C6=CC=CC=C6C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4=CC=CS4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C6=CC=CC=C6C

InChI

InChI=1S/C33H32N4O5S2/c1-20-7-3-4-10-24(20)30(38)26-27(31-21(2)12-18-44-31)29(33(40)35-15-13-34-14-16-35)36(32(39)25-11-6-17-43-25)28(26)22-8-5-9-23(19-22)37(41)42/h3-12,17-19,26-29,34H,13-16H2,1-2H3