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

Systemtic Name: S-[(4-methoxyphenyl)methyl] (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)carbamothioate Openeye Name: S-[(4-methoxyphenyl)methyl] (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)carbamothioate CAS Name: (NZ)-N-(6-ethoxy-1-phenyl-4-pyridazinylidene)carbamothioic acid S-[(4-methoxyphenyl)methyl] ester IUPAC Name: S-[(4-methoxyphenyl)methyl] (NZ)-N-(6-ethoxy-1-phenylpyridazin-4-ylidene)carbamothioate Traditional Name: (NZ)-N-(6-ethoxy-1-phenyl-pyridazin-4-ylidene)thiocarbamic acid S-p-anisyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3S/c1-3-27-20-13-17(14-22-24(20)18-7-5-4-6-8-18)23-21(25)28-15-16-9-11-19(26-2)12-10-16/h4-14H,3,15H2,1-2H3/b23-17-