1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(Z)-1-(2-methoxy-5-methyl-phenyl)ethylideneamino]thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(Z)-1-(2-methoxy-5-methyl-phenyl)ethylideneamino]thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[(Z)-1-(2-methoxy-5-methyl-phenyl)ethylideneamino]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[(Z)-1-(2-methoxy-5-methylphenyl)ethylideneamino]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(Z)-1-(2-methoxy-5-methylphenyl)ethylideneamino]thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[(Z)-1-(2-methoxy-5-methyl-phenyl)ethylideneamino]thiourea Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=NNC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C(=N\NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)/C

InChI

InChI=1S/C22H25N5O2S/c1-14-11-12-19(29-5)18(13-14)15(2)24-25-22(30)23-20-16(3)26(4)27(21(20)28)17-9-7-6-8-10-17/h6-13H,1-5H3,(H2,23,25,30)/b24-15-