1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H23N5O3S2/c1-14-18(19(26)25(24(14)2)16-6-4-3-5-7-16)23-20(29)22-13-12-15-8-10-17(11-9-15)30(21,27)28/h3-11H,12-13H2,1-2H3,(H2,21,27,28)(H2,22,23,29)