1-(2,3-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-(4-sulfamoylbenzyl)thiourea Formula: C16H19N3O2S2 MolecularWeight: 349.47096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C16H19N3O2S2/c1-11-4-3-5-15(12(11)2)19-16(22)18-10-13-6-8-14(9-7-13)23(17,20)21/h3-9H,10H2,1-2H3,(H2,17,20,21)(H2,18,19,22)