2-(2-methylphenyl)-N-[(4-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(2-methylphenyl)-N-[(4-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(o-tolyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(2-methylphenyl)-N-[[4-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-methylphenyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(o-tolyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]thiocarbamoyl]acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C21H23N3O2S/c1-15-6-2-3-7-17(15)14-19(25)23-21(27)22-18-10-8-16(9-11-18)20(26)24-12-4-5-13-24/h2-3,6-11H,4-5,12-14H2,1H3,(H2,22,23,25,27)