S-propan-2-yl (NZ)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate

Systemtic Name: S-propan-2-yl (NZ)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate Openeye Name: S-isopropyl (NZ)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate CAS Name: (NZ)-N-(1-phenyl-6-propoxy-4-pyridazinylidene)carbamothioic acid S-propan-2-yl ester IUPAC Name: S-propan-2-yl (NZ)-N-(1-phenyl-6-propoxypyridazin-4-ylidene)carbamothioate Traditional Name: (NZ)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)thiocarbamic acid S-isopropyl ester Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=NC(=O)SC(C)C)C=NN1C2=CC=CC=C2

Isomeric SMILES

CCCOC1=C/C(=N/C(=O)SC(C)C)/C=NN1C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O2S/c1-4-10-22-16-11-14(19-17(21)23-13(2)3)12-18-20(16)15-8-6-5-7-9-15/h5-9,11-13H,4,10H2,1-3H3/b19-14-