1-[(Z)-(4-tert-butylphenyl)methylideneamino]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[(Z)-(4-tert-butylphenyl)methylideneamino]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiourea Openeye Name: 1-[(Z)-(4-tert-butylphenyl)methyleneamino]-3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiourea CAS Name: 1-[(Z)-(4-tert-butylphenyl)methylideneamino]-3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)thiourea IUPAC Name: 1-[(Z)-(4-tert-butylphenyl)methylideneamino]-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)thiourea Traditional Name: 1-[(Z)-(4-tert-butylbenzylidene)amino]-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NN=CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5OS/c1-16-20(21(29)28(27(16)5)19-9-7-6-8-10-19)25-22(30)26-24-15-17-11-13-18(14-12-17)23(2,3)4/h6-15H,1-5H3,(H2,25,26,30)/b24-15-