N-[1-[(2-chloranyl-4-methyl-phenyl)carbamothioyl]pyrrolidin-3-yl]-2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: N-[1-[(2-chloranyl-4-methyl-phenyl)carbamothioyl]pyrrolidin-3-yl]-2,2,2-tris(fluoranyl)ethanamide Openeye Name: N-[1-[(2-chloro-4-methyl-phenyl)carbamothioyl]pyrrolidin-3-yl]-2,2,2-trifluoro-acetamide CAS Name: N-[1-[(2-chloro-4-methylanilino)-sulfanylidenemethyl]-3-pyrrolidinyl]-2,2,2-trifluoroacetamide IUPAC Name: N-[1-[(2-chloro-4-methylphenyl)carbamothioyl]pyrrolidin-3-yl]-2,2,2-trifluoroacetamide Traditional Name: N-[1-[(2-chloro-4-methyl-phenyl)thiocarbamoyl]pyrrolidin-3-yl]-2,2,2-trifluoro-acetamide Formula: C14H15ClF3N3OS MolecularWeight: 365.80161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N2CCC(C2)NC(=O)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N2CCC(C2)NC(=O)C(F)(F)F)Cl

InChI

InChI=1S/C14H15ClF3N3OS/c1-8-2-3-11(10(15)6-8)20-13(23)21-5-4-9(7-21)19-12(22)14(16,17)18/h2-3,6,9H,4-5,7H2,1H3,(H,19,22)(H,20,23)