3-(4-acetamidophenyl)-1-cyclobutylcarbonyl-4-(2,5-dimethylthiophen-3-yl)carbonyl-5-(3-nitrophenyl)pyrrolidine-2-carboxamide

Systemtic Name: 3-(4-acetamidophenyl)-1-cyclobutylcarbonyl-4-(2,5-dimethylthiophen-3-yl)carbonyl-5-(3-nitrophenyl)pyrrolidine-2-carboxamide Openeye Name: 3-(4-acetamidophenyl)-1-(cyclobutanecarbonyl)-4-(2,5-dimethylthiophene-3-carbonyl)-5-(3-nitrophenyl)pyrrolidine-2-carboxamide CAS Name: 3-(4-acetamidophenyl)-1-[cyclobutyl(oxo)methyl]-4-[(2,5-dimethyl-3-thiophenyl)-oxomethyl]-5-(3-nitrophenyl)-2-pyrrolidinecarboxamide IUPAC Name: 3-(4-acetamidophenyl)-1-(cyclobutanecarbonyl)-4-(2,5-dimethylthiophene-3-carbonyl)-5-(3-nitrophenyl)pyrrolidine-2-carboxamide Traditional Name: 3-(4-acetamidophenyl)-1-(cyclobutanecarbonyl)-4-(2,5-dimethylthiophene-3-carbonyl)-5-(3-nitrophenyl)pyrrolidine-2-carboxamide Formula: C31H32N4O6S MolecularWeight: 588.67398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)C2C(C(N(C2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4CCC4)C(=O)N)C5=CC=C(C=C5)NC(=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)C2C(C(N(C2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4CCC4)C(=O)N)C5=CC=C(C=C5)NC(=O)C

InChI

InChI=1S/C31H32N4O6S/c1-16-14-24(17(2)42-16)29(37)26-25(19-10-12-22(13-11-19)33-18(3)36)28(30(32)38)34(31(39)20-6-4-7-20)27(26)21-8-5-9-23(15-21)35(40)41/h5,8-15,20,25-28H,4,6-7H2,1-3H3,(H2,32,38)(H,33,36)