1-(3-chlorophenyl)-3-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[3-[(3,4-dimethylphenyl)thio]-1-oxopropyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[3-[(3,4-dimethylphenyl)thio]propanoylamino]thiourea Formula: C18H20ClN3OS2 MolecularWeight: 393.9539

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NNC(=S)NC2=CC(=CC=C2)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NNC(=S)NC2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C18H20ClN3OS2/c1-12-6-7-16(10-13(12)2)25-9-8-17(23)21-22-18(24)20-15-5-3-4-14(19)11-15/h3-7,10-11H,8-9H2,1-2H3,(H,21,23)(H2,20,22,24)