[2-azanylidene-2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]ethyl] 4-chloranylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=N)COC(=O)C2=CC=C(C=C2)Cl)CSC3=CC=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=N)COC(=O)C2=CC=C(C=C2)Cl)CSC3=CC=CC=N3

InChI

InChI=1S/C22H19ClN2O3S/c1-27-20-10-7-16(12-17(20)14-29-21-4-2-3-11-25-21)19(24)13-28-22(26)15-5-8-18(23)9-6-15/h2-12,24H,13-14H2,1H3