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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-homoveratryl-3-(4-sulfamoylphenyl)thiourea Formula: C17H21N3O4S2 MolecularWeight: 395.49634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)OC

InChI

InChI=1S/C17H21N3O4S2/c1-23-15-8-3-12(11-16(15)24-2)9-10-19-17(25)20-13-4-6-14(7-5-13)26(18,21)22/h3-8,11H,9-10H2,1-2H3,(H2,18,21,22)(H2,19,20,25)