(5,7-diethyl-2-oxidanylidene-3-phenylsulfanyl-1,6-naphthyridin-1-yl)methyl benzoate

Systemtic Name: (5,7-diethyl-2-oxidanylidene-3-phenylsulfanyl-1,6-naphthyridin-1-yl)methyl benzoate Openeye Name: (5,7-diethyl-2-oxo-3-phenylsulfanyl-1,6-naphthyridin-1-yl)methyl benzoate CAS Name: benzoic acid [5,7-diethyl-2-oxo-3-(phenylthio)-1,6-naphthyridin-1-yl]methyl ester IUPAC Name: (5,7-diethyl-2-oxo-3-phenylsulfanyl-1,6-naphthyridin-1-yl)methyl benzoate Traditional Name: benzoic acid [5,7-diethyl-2-keto-3-(phenylthio)-1,6-naphthyridin-1-yl]methyl ester Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C=C(C(=O)N(C2=C1)COC(=O)C3=CC=CC=C3)SC4=CC=CC=C4)CC

Isomeric SMILES

CCC1=NC(=C2C=C(C(=O)N(C2=C1)COC(=O)C3=CC=CC=C3)SC4=CC=CC=C4)CC

InChI

InChI=1S/C26H24N2O3S/c1-3-19-15-23-21(22(4-2)27-19)16-24(32-20-13-9-6-10-14-20)25(29)28(23)17-31-26(30)18-11-7-5-8-12-18/h5-16H,3-4,17H2,1-2H3