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

Systemtic Name: S-pentyl (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate Openeye Name: S-pentyl (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)carbamothioate CAS Name: (NE)-N-(1-phenyl-6-propoxy-4-pyridazinylidene)carbamothioic acid S-pentyl ester IUPAC Name: S-pentyl (NE)-N-(1-phenyl-6-propoxypyridazin-4-ylidene)carbamothioate Traditional Name: (NE)-N-(1-phenyl-6-propoxy-pyridazin-4-ylidene)thiocarbamic acid S-amyl ester Formula: C19H25N3O2S MolecularWeight: 359.4857

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O2S/c1-3-5-9-13-25-19(23)21-16-14-18(24-12-4-2)22(20-15-16)17-10-7-6-8-11-17/h6-8,10-11,14-15H,3-5,9,12-13H2,1-2H3/b21-16+