S-[(4-chlorophenyl)methyl] (NZ)-N-(1-phenylpyridazin-4-ylidene)carbamothioate

Systemtic Name: S-[(4-chlorophenyl)methyl] (NZ)-N-(1-phenylpyridazin-4-ylidene)carbamothioate Openeye Name: S-[(4-chlorophenyl)methyl] (NZ)-N-(1-phenylpyridazin-4-ylidene)carbamothioate CAS Name: (NZ)-N-(1-phenyl-4-pyridazinylidene)carbamothioic acid S-[(4-chlorophenyl)methyl] ester IUPAC Name: S-[(4-chlorophenyl)methyl] (NZ)-N-(1-phenylpyridazin-4-ylidene)carbamothioate Traditional Name: (NZ)-N-(1-phenylpyridazin-4-ylidene)thiocarbamic acid S-(4-chlorobenzyl) ester Formula: C18H14ClN3OS MolecularWeight: 355.84126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=CC(=NC(=O)SCC3=CC=C(C=C3)Cl)C=N2

Isomeric SMILES

C1=CC=C(C=C1)N2C=C/C(=N/C(=O)SCC3=CC=C(C=C3)Cl)/C=N2

InChI

InChI=1S/C18H14ClN3OS/c19-15-8-6-14(7-9-15)13-24-18(23)21-16-10-11-22(20-12-16)17-4-2-1-3-5-17/h1-12H,13H2/b21-16-