[4-[[2-[(2,4-dimethoxyphenyl)methylsulfanyl]pyridin-3-yl]carbonylamino]pyridin-2-yl]methyl butanoate

Systemtic Name: [4-[[2-[(2,4-dimethoxyphenyl)methylsulfanyl]pyridin-3-yl]carbonylamino]pyridin-2-yl]methyl butanoate Openeye Name: [4-[[2-[(2,4-dimethoxyphenyl)methylsulfanyl]pyridine-3-carbonyl]amino]-2-pyridyl]methyl butanoate CAS Name: butanoic acid [4-[[[2-[(2,4-dimethoxyphenyl)methylthio]-3-pyridinyl]-oxomethyl]amino]-2-pyridinyl]methyl ester IUPAC Name: [4-[[2-[(2,4-dimethoxyphenyl)methylsulfanyl]pyridine-3-carbonyl]amino]pyridin-2-yl]methyl butanoate Traditional Name: butyric acid [4-[[2-[(2,4-dimethoxybenzyl)thio]nicotinoyl]amino]-2-pyridyl]methyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1=NC=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCC(=O)OCC1=NC=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C25H27N3O5S/c1-4-6-23(29)33-15-19-13-18(10-12-26-19)28-24(30)21-7-5-11-27-25(21)34-16-17-8-9-20(31-2)14-22(17)32-3/h5,7-14H,4,6,15-16H2,1-3H3,(H,26,28,30)