1-(3-chloranyl-2-methyl-phenyl)-3-[(4-ethanoylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(4-ethanoylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(4-acetylphenyl)-3-[(3-chloro-2-methyl-phenyl)carbamothioylamino]thiourea CAS Name: 1-[[(4-acetylanilino)-sulfanylidenemethyl]amino]-3-(3-chloro-2-methylphenyl)thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[(3-chloro-2-methylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]thiourea Formula: C17H17ClN4OS2 MolecularWeight: 392.92608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C17H17ClN4OS2/c1-10-14(18)4-3-5-15(10)20-17(25)22-21-16(24)19-13-8-6-12(7-9-13)11(2)23/h3-9H,1-2H3,(H2,19,21,24)(H2,20,22,25)