1-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylphenyl)thiourea

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylphenyl)thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylphenyl)thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[2-(phenylthio)phenyl]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylphenyl)thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[2-(phenylthio)phenyl]thiourea Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O2S2/c1-24-18-13-12-15(14-19(18)25-2)22-21(26)23-17-10-6-7-11-20(17)27-16-8-4-3-5-9-16/h3-14H,1-2H3,(H2,22,23,26)