(4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C23H23N3O3S/c1-30-23-24-15-20(26(23)19-7-3-2-4-8-19)22(28)29-16-17-9-11-18(12-10-17)21(27)25-13-5-6-14-25/h2-4,7-12,15H,5-6,13-14,16H2,1H3