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

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-4-pyrazolyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[1-(2-fluorobenzyl)pyrazol-4-yl]-3-(4-sulfamoylphenyl)thiourea Formula: C17H16FN5O2S2 MolecularWeight: 405.469643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN5O2S2/c18-16-4-2-1-3-12(16)10-23-11-14(9-20-23)22-17(26)21-13-5-7-15(8-6-13)27(19,24)25/h1-9,11H,10H2,(H2,19,24,25)(H2,21,22,26)