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

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclobutylcarbonyl-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxamide Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclobutanecarbonyl)-3-(3-methoxyphenyl)-5-styryl-pyrrolidine-2-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-[cyclobutyl(oxo)methyl]-3-(3-methoxyphenyl)-5-(2-phenylethenyl)-2-pyrrolidinecarboxamide IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclobutanecarbonyl)-3-(3-methoxyphenyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxamide Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclobutanecarbonyl)-3-(3-methoxyphenyl)-5-styryl-pyrrolidine-2-carboxamide Formula: C30H29ClN2O4S MolecularWeight: 549.08026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)N)C(=O)C3CCC3)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)C3CCC3)C=CC4=CC=CC=C4)C(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C30H29ClN2O4S/c1-37-21-12-6-11-20(17-21)25-26(28(34)23-15-16-24(31)38-23)22(14-13-18-7-3-2-4-8-18)33(27(25)29(32)35)30(36)19-9-5-10-19/h2-4,6-8,11-17,19,22,25-27H,5,9-10H2,1H3,(H2,32,35)