1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-phenylsulfanylphenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-phenylsulfanylphenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-phenylsulfanylphenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(phenylthio)phenyl]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-phenylsulfanylphenyl)thiourea Traditional Name: 1-homoveratryl-3-[2-(phenylthio)phenyl]thiourea Formula: C23H24N2O2S2 MolecularWeight: 424.57886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O2S2/c1-26-20-13-12-17(16-21(20)27-2)14-15-24-23(28)25-19-10-6-7-11-22(19)29-18-8-4-3-5-9-18/h3-13,16H,14-15H2,1-2H3,(H2,24,25,28)