(2S)-2-[(3-methylphenyl)carbamothioylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[(3-methylphenyl)carbamothioylamino]-N-propyl-propanamide Openeye Name: (2S)-2-(m-tolylcarbamothioylamino)-N-propyl-propanamide CAS Name: (2S)-2-[[(3-methylanilino)-sulfanylidenemethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[(3-methylphenyl)carbamothioylamino]-N-propylpropanamide Traditional Name: (2S)-2-(m-tolylthiocarbamoylamino)-N-propyl-propionamide Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=S)NC1=CC=CC(=C1)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=S)NC1=CC=CC(=C1)C

InChI

InChI=1S/C14H21N3OS/c1-4-8-15-13(18)11(3)16-14(19)17-12-7-5-6-10(2)9-12/h5-7,9,11H,4,8H2,1-3H3,(H,15,18)(H2,16,17,19)/t11-/m0/s1