6-(3-methylsulfanylpropanoyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one

Systemtic Name: 6-(3-methylsulfanylpropanoyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one Openeye Name: 6-(3-methylsulfanylpropanoyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-(4-pyridyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one CAS Name: 6-[3-(methylthio)-1-oxopropyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one IUPAC Name: 6-(3-methylsulfanylpropanoyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one Traditional Name: 6-[3-(methylthio)propanoyl]-1-(2-piperidin-1-ium-1-ylethyl)-3-(4-pyridyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Formula: C24H33N4O2S+ MolecularWeight: 441.60942

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCC2=C(C1)C=C(C(=O)N2CC[NH+]3CCCCC3)C4=CC=NC=C4

Isomeric SMILES

CSCCC(=O)N1CCC2=C(C1)C=C(C(=O)N2CC[NH+]3CCCCC3)C4=CC=NC=C4

InChI

InChI=1S/C24H32N4O2S/c1-31-16-8-23(29)27-13-7-22-20(18-27)17-21(19-5-9-25-10-6-19)24(30)28(22)15-14-26-11-3-2-4-12-26/h5-6,9-10,17H,2-4,7-8,11-16,18H2,1H3/p+1