5-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-(3-fluorophenyl)carbonyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-(3-fluorophenyl)carbonyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-(3-fluorobenzoyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-[(3-fluorophenyl)-oxomethyl]-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-(3-fluorobenzoyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-(3-fluorobenzoyl)-4-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C30H22ClFN2O5S MolecularWeight: 577.022483

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3C(C(C(N3C(=O)C4=CC(=CC=C4)F)C(=O)N)C5=CC=C(C=C5)Cl)C(=O)C6=CC=CS6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3C(C(C(N3C(=O)C4=CC(=CC=C4)F)C(=O)N)C5=CC=C(C=C5)Cl)C(=O)C6=CC=CS6

InChI

InChI=1S/C30H22ClFN2O5S/c31-19-9-6-16(7-10-19)24-25(28(35)23-5-2-12-40-23)26(17-8-11-21-22(14-17)39-15-38-21)34(27(24)29(33)36)30(37)18-3-1-4-20(32)13-18/h1-14,24-27H,15H2,(H2,33,36)