1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2-methyl-1-oxidanyl-propan-2-yl)thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2-methyl-1-oxidanyl-propan-2-yl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(2-hydroxy-1,1-dimethyl-ethyl)thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(1-hydroxy-2-methylpropan-2-yl)thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(1-hydroxy-2-methylpropan-2-yl)thiourea Traditional Name: 1-(2-hydroxy-1,1-dimethyl-ethyl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O2S/c1-11-13(17-15(23)18-16(2,3)10-21)14(22)20(19(11)4)12-8-6-5-7-9-12/h5-9,21H,10H2,1-4H3,(H2,17,18,23)