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

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(Z)-1-(4-fluorophenyl)ethylideneamino]thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[(Z)-1-(4-fluorophenyl)ethylideneamino]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[(Z)-1-(4-fluorophenyl)ethylideneamino]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(Z)-1-(4-fluorophenyl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-(4-fluorophenyl)ethylideneamino]-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C20H20FN5OS MolecularWeight: 397.469103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20FN5OS/c1-13(15-9-11-16(21)12-10-15)23-24-20(28)22-18-14(2)25(3)26(19(18)27)17-7-5-4-6-8-17/h4-12H,1-3H3,(H2,22,24,28)/b23-13-