[(E)-[6-(4-chlorophenyl)sulfanylpyridin-3-yl]methylideneamino] 3-methylbutanoate

Systemtic Name: [(E)-[6-(4-chlorophenyl)sulfanylpyridin-3-yl]methylideneamino] 3-methylbutanoate Openeye Name: [(E)-[6-(4-chlorophenyl)sulfanyl-3-pyridyl]methyleneamino] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [(E)-[6-[(4-chlorophenyl)thio]-3-pyridinyl]methylideneamino] ester IUPAC Name: [(E)-[6-(4-chlorophenyl)sulfanylpyridin-3-yl]methylideneamino] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [(E)-[6-[(4-chlorophenyl)thio]-3-pyridyl]methyleneamino] ester Formula: C17H17ClN2O2S MolecularWeight: 348.84708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)ON=CC1=CN=C(C=C1)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(=O)O/N=C/C1=CN=C(C=C1)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O2S/c1-12(2)9-17(21)22-20-11-13-3-8-16(19-10-13)23-15-6-4-14(18)5-7-15/h3-8,10-12H,9H2,1-2H3/b20-11+