1-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-(4-sulfamoylphenyl)thiourea Formula: C17H16ClN5O2S2 MolecularWeight: 421.92424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)CN3C=C(C=N3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)CN3C=C(C=N3)Cl

InChI

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