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

Systemtic Name: 1-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]-3-(4-sulfamoylphenyl)thiourea Formula: C17H15BrFN5O2S2 MolecularWeight: 484.365703

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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)Br)F

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrFN5O2S2/c18-14-10-24(9-11-3-1-2-4-15(11)19)23-16(14)22-17(27)21-12-5-7-13(8-6-12)28(20,25)26/h1-8,10H,9H2,(H2,20,25,26)(H2,21,22,23,27)