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

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[4-(tetrahydrofuran-2-ylmethylsulfamoyl)phenyl]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[4-(2-oxolanylmethylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[4-(tetrahydrofurfurylsulfamoyl)phenyl]thiourea Formula: C23H27N5O4S2 MolecularWeight: 501.62158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NCC4CCCO4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NCC4CCCO4

InChI

InChI=1S/C23H27N5O4S2/c1-16-21(22(29)28(27(16)2)18-7-4-3-5-8-18)26-23(33)25-17-10-12-20(13-11-17)34(30,31)24-15-19-9-6-14-32-19/h3-5,7-8,10-13,19,24H,6,9,14-15H2,1-2H3,(H2,25,26,33)