1-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[1-(2-chlorobenzyl)pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea Formula: C17H16ClN5O2S2 MolecularWeight: 421.92424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN5O2S2/c18-15-4-2-1-3-12(15)11-23-10-9-16(22-23)21-17(26)20-13-5-7-14(8-6-13)27(19,24)25/h1-10H,11H2,(H2,19,24,25)(H2,20,21,22,26)