[(E)-1-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]ethylideneamino] 4-chloranylbenzoate

Systemtic Name: [(E)-1-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]ethylideneamino] 4-chloranylbenzoate Openeye Name: [(E)-1-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]ethylideneamino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(E)-1-[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]ethylideneamino] ester IUPAC Name: [(E)-1-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]ethylideneamino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(E)-1-[4-methoxy-3-[(2-pyridylthio)methyl]phenyl]ethylideneamino] ester Formula: C22H19ClN2O3S MolecularWeight: 426.91586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=CC=C(C=C1)Cl)C2=CC(=C(C=C2)OC)CSC3=CC=CC=N3

Isomeric SMILES

C/C(=N\OC(=O)C1=CC=C(C=C1)Cl)/C2=CC(=C(C=C2)OC)CSC3=CC=CC=N3

InChI

InChI=1S/C22H19ClN2O3S/c1-15(25-28-22(26)16-6-9-19(23)10-7-16)17-8-11-20(27-2)18(13-17)14-29-21-5-3-4-12-24-21/h3-13H,14H2,1-2H3/b25-15+