(2R)-N-(3-chlorophenyl)-2-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl-propyl-amino]propanamide

Systemtic Name: (2R)-N-(3-chlorophenyl)-2-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl-propyl-amino]propanamide Openeye Name: (2R)-N-(3-chlorophenyl)-2-[(3-fluoro-4-methyl-phenyl)carbamothioyl-propyl-amino]propanamide CAS Name: (2R)-N-(3-chlorophenyl)-2-[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]-propylamino]propanamide IUPAC Name: (2R)-N-(3-chlorophenyl)-2-[(3-fluoro-4-methylphenyl)carbamothioyl-propylamino]propanamide Traditional Name: (2R)-N-(3-chlorophenyl)-2-[(3-fluoro-4-methyl-phenyl)thiocarbamoyl-propyl-amino]propionamide Formula: C20H23ClFN3OS MolecularWeight: 407.932523

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C)C(=O)NC1=CC(=CC=C1)Cl)C(=S)NC2=CC(=C(C=C2)C)F

Isomeric SMILES

CCCN([C@H](C)C(=O)NC1=CC(=CC=C1)Cl)C(=S)NC2=CC(=C(C=C2)C)F

InChI

InChI=1S/C20H23ClFN3OS/c1-4-10-25(20(27)24-17-9-8-13(2)18(22)12-17)14(3)19(26)23-16-7-5-6-15(21)11-16/h5-9,11-12,14H,4,10H2,1-3H3,(H,23,26)(H,24,27)/t14-/m1/s1