[3-methoxy-4-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]phenyl] thiocyanate

Systemtic Name: [3-methoxy-4-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]phenyl] thiocyanate Openeye Name: [3-methoxy-4-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-methoxy-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]phenyl] ester IUPAC Name: [3-methoxy-4-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylamino]-3-methoxy-phenyl] ester Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=C(C=C(C=C2)SC#N)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1=CNC2=C(C=C(C=C2)SC#N)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H16N4O2S/c1-13-16(19(24)23(22-13)14-6-4-3-5-7-14)11-21-17-9-8-15(26-12-20)10-18(17)25-2/h3-11,21H,1-2H3