1-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[1-(p-tolylmethyl)pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[1-[(4-methylphenyl)methyl]-4-pyrazolyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[1-(4-methylbenzyl)pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea Formula: C18H19N5O2S2 MolecularWeight: 401.50576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C=N2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C=N2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H19N5O2S2/c1-13-2-4-14(5-3-13)11-23-12-16(10-20-23)22-18(26)21-15-6-8-17(9-7-15)27(19,24)25/h2-10,12H,11H2,1H3,(H2,19,24,25)(H2,21,22,26)