1-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethoxyphenyl)thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethoxyphenyl)thiourea Openeye Name: 1-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethoxyphenyl)thiourea CAS Name: 1-[2-[(4-chlorophenyl)thio]phenyl]-3-(3,5-dimethoxyphenyl)thiourea IUPAC Name: 1-[2-(4-chlorophenyl)sulfanylphenyl]-3-(3,5-dimethoxyphenyl)thiourea Traditional Name: 1-[2-[(4-chlorophenyl)thio]phenyl]-3-(3,5-dimethoxyphenyl)thiourea Formula: C21H19ClN2O2S2 MolecularWeight: 430.97076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H19ClN2O2S2/c1-25-16-11-15(12-17(13-16)26-2)23-21(27)24-19-5-3-4-6-20(19)28-18-9-7-14(22)8-10-18/h3-13H,1-2H3,(H2,23,24,27)