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

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[2-(thiophen-2-ylsulfonylamino)phenyl]thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[2-(2-thienylsulfonylamino)phenyl]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[2-(thiophen-2-ylsulfonylamino)phenyl]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[2-(thiophen-2-ylsulfonylamino)phenyl]thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[2-(2-thienylsulfonylamino)phenyl]thiourea Formula: C22H21N5O3S3 MolecularWeight: 499.62884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=CC=C3NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=CC=C3NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H21N5O3S3/c1-15-20(21(28)27(26(15)2)16-9-4-3-5-10-16)24-22(31)23-17-11-6-7-12-18(17)25-33(29,30)19-13-8-14-32-19/h3-14,25H,1-2H3,(H2,23,24,31)