4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclohexylcarbonyl-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxamide

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclohexylcarbonyl-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxamide Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclohexanecarbonyl)-3-(3-methoxyphenyl)-5-styryl-pyrrolidine-2-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-[cyclohexyl(oxo)methyl]-3-(3-methoxyphenyl)-5-(2-phenylethenyl)-2-pyrrolidinecarboxamide IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclohexanecarbonyl)-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxamide Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclohexanecarbonyl)-3-(3-methoxyphenyl)-5-styryl-pyrrolidine-2-carboxamide Formula: C32H33ClN2O4S MolecularWeight: 577.13342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)N)C(=O)C3CCCCC3)C=CC4=CC=CC=C4)C(=O)C5=CC=C(S5)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)N)C(=O)C3CCCCC3)C=CC4=CC=CC=C4)C(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C32H33ClN2O4S/c1-39-23-14-8-13-22(19-23)27-28(30(36)25-17-18-26(33)40-25)24(16-15-20-9-4-2-5-10-20)35(29(27)31(34)37)32(38)21-11-6-3-7-12-21/h2,4-5,8-10,13-19,21,24,27-29H,3,6-7,11-12H2,1H3,(H2,34,37)