1-[4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-thiourea

Systemtic Name: 1-[4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-thiourea Openeye Name: 1-[4-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanylphenyl]-3-phenyl-thiourea CAS Name: 1-[4-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanylphenyl]-3-phenylthiourea Traditional Name: 1-[4-[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]phenyl]-3-phenyl-thiourea Formula: C23H22N2O3S2 MolecularWeight: 438.56238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3)OC

InChI

InChI=1S/C23H22N2O3S2/c1-27-21-13-8-16(14-22(21)28-2)20(26)15-30-19-11-9-18(10-12-19)25-23(29)24-17-6-4-3-5-7-17/h3-14H,15H2,1-2H3,(H2,24,25,29)