S-[(4-methylphenyl)methyl] (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)carbamothioate

Systemtic Name: S-[(4-methylphenyl)methyl] (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)carbamothioate Openeye Name: S-(p-tolylmethyl) (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)carbamothioate CAS Name: (NZ)-N-(6-ethoxy-1-phenyl-4-pyridazinylidene)carbamothioic acid S-[(4-methylphenyl)methyl] ester IUPAC Name: S-[(4-methylphenyl)methyl] (NZ)-N-(6-ethoxy-1-phenylpyridazin-4-ylidene)carbamothioate Traditional Name: (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)thiocarbamic acid S-(4-methylbenzyl) ester Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=NC(=O)SCC2=CC=C(C=C2)C)C=NN1C3=CC=CC=C3

Isomeric SMILES

CCOC1=C/C(=N/C(=O)SCC2=CC=C(C=C2)C)/C=NN1C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-3-26-20-13-18(14-22-24(20)19-7-5-4-6-8-19)23-21(25)27-15-17-11-9-16(2)10-12-17/h4-14H,3,15H2,1-2H3/b23-18-