1-(3-chloranyl-2-methyl-phenyl)-3-[(E)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(E)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(E)-(2,4-dimethyl-5-oxo-1-phenyl-pyrazol-3-yl)methyleneamino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(E)-(2,4-dimethyl-5-oxo-1-phenyl-3-pyrazolyl)methylideneamino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(E)-(2,4-dimethyl-5-oxo-1-phenylpyrazol-3-yl)methylideneamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(E)-(5-keto-2,4-dimethyl-1-phenyl-3-pyrazolin-3-yl)methyleneamino]thiourea Formula: C20H20ClN5OS MolecularWeight: 413.9237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NN=CC2=C(C(=O)N(N2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N/N=C/C2=C(C(=O)N(N2C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H20ClN5OS/c1-13-16(21)10-7-11-17(13)23-20(28)24-22-12-18-14(2)19(27)26(25(18)3)15-8-5-4-6-9-15/h4-12H,1-3H3,(H2,23,24,28)/b22-12+