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

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-homoveratryl-3-(4-sec-butylphenyl)thiourea Formula: C21H28N2O2S MolecularWeight: 372.52422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H28N2O2S/c1-5-15(2)17-7-9-18(10-8-17)23-21(26)22-13-12-16-6-11-19(24-3)20(14-16)25-4/h6-11,14-15H,5,12-13H2,1-4H3,(H2,22,23,26)