[2-azanylidene-2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]ethyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-azanylidene-2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]ethyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-imino-2-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]ethyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic 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] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-imino-2-[4-methoxy-3-[(2-pyridylthio)methyl]phenyl]ethyl] ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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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)OC)OC)OC)CSC3=CC=CC=N3

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O6S/c1-29-20-9-8-16(11-18(20)15-34-23-7-5-6-10-27-23)19(26)14-33-25(28)17-12-21(30-2)24(32-4)22(13-17)31-3/h5-13,26H,14-15H2,1-4H3