(2S)-2-[(3-bromophenyl)carbamothioyl-ethyl-amino]-N-(4-methylphenyl)propanamide

Systemtic Name: (2S)-2-[(3-bromophenyl)carbamothioyl-ethyl-amino]-N-(4-methylphenyl)propanamide Openeye Name: (2S)-2-[(3-bromophenyl)carbamothioyl-ethyl-amino]-N-(p-tolyl)propanamide CAS Name: (2S)-2-[[(3-bromoanilino)-sulfanylidenemethyl]-ethylamino]-N-(4-methylphenyl)propanamide IUPAC Name: (2S)-2-[(3-bromophenyl)carbamothioyl-ethylamino]-N-(4-methylphenyl)propanamide Traditional Name: (2S)-2-[(3-bromophenyl)thiocarbamoyl-ethyl-amino]-N-(p-tolyl)propionamide Formula: C19H22BrN3OS MolecularWeight: 420.36648

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C(=O)NC1=CC=C(C=C1)C)C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

CCN([C@@H](C)C(=O)NC1=CC=C(C=C1)C)C(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H22BrN3OS/c1-4-23(19(25)22-17-7-5-6-15(20)12-17)14(3)18(24)21-16-10-8-13(2)9-11-16/h5-12,14H,4H2,1-3H3,(H,21,24)(H,22,25)/t14-/m0/s1