1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C20H30N4OS MolecularWeight: 374.5434

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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)CC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4OS/c1-14-16(21-18(26)22-20(5,6)13-19(2,3)4)17(25)24(23(14)7)15-11-9-8-10-12-15/h8-12H,13H2,1-7H3,(H2,21,22,26)