1-[2-(4-chlorophenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea Openeye Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea CAS Name: 1-[2-(4-chlorophenyl)ethyl]-3-[[(3,5-dimethylanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea Traditional Name: 1-[2-(4-chlorophenyl)ethyl]-3-[(3,5-dimethylphenyl)thiocarbamoylamino]thiourea Formula: C18H21ClN4S2 MolecularWeight: 392.96914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=S)NCCC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=S)NCCC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C18H21ClN4S2/c1-12-9-13(2)11-16(10-12)21-18(25)23-22-17(24)20-8-7-14-3-5-15(19)6-4-14/h3-6,9-11H,7-8H2,1-2H3,(H2,20,22,24)(H2,21,23,25)