S-butyl (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate

Systemtic Name: S-butyl (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate Openeye Name: S-butyl (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate CAS Name: (NE)-N-(1-phenyl-6-propoxy-4-pyridazinylidene)carbamothioic acid S-butyl ester IUPAC Name: S-butyl (NE)-N-(1-phenyl-6-propoxypyridazin-4-ylidene)carbamothioate Traditional Name: (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)thiocarbamic acid S-butyl ester Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=O)N=C1C=C(N(N=C1)C2=CC=CC=C2)OCCC

Isomeric SMILES

CCCCSC(=O)/N=C/1\C=C(N(N=C1)C2=CC=CC=C2)OCCC

InChI

InChI=1S/C18H23N3O2S/c1-3-5-12-24-18(22)20-15-13-17(23-11-4-2)21(19-14-15)16-9-7-6-8-10-16/h6-10,13-14H,3-5,11-12H2,1-2H3/b20-15+