(2S)-2-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[(2-chloro-4,6-dimethyl-phenyl)carbamothioylamino]-N-propyl-propanamide CAS Name: (2S)-2-[[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[(2-chloro-4,6-dimethylphenyl)carbamothioylamino]-N-propylpropanamide Traditional Name: (2S)-2-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoylamino]-N-propyl-propionamide Formula: C15H22ClN3OS MolecularWeight: 327.87268

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=S)NC1=C(C=C(C=C1Cl)C)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=S)NC1=C(C=C(C=C1Cl)C)C

InChI

InChI=1S/C15H22ClN3OS/c1-5-6-17-14(20)11(4)18-15(21)19-13-10(3)7-9(2)8-12(13)16/h7-8,11H,5-6H2,1-4H3,(H,17,20)(H2,18,19,21)/t11-/m0/s1