6-methyl-2-(pyridin-3-ylmethylsulfanyl)-4-thiophen-3-yl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-3-carbonitrile

Systemtic Name: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)-4-thiophen-3-yl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-3-carbonitrile Openeye Name: 6-methyl-2-(3-pyridylmethylsulfanyl)-4-(3-thienyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-3-carbonitrile CAS Name: 6-methyl-2-(3-pyridinylmethylthio)-4-(3-thiophenyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-3-carbonitrile IUPAC Name: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)-4-thiophen-3-yl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-3-carbonitrile Traditional Name: 6-methyl-2-(3-pyridylmethylthio)-4-(3-thienyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-3-carbonitrile Formula: C20H19N4S2+ MolecularWeight: 379.52166

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C(=C(C(=N2)SCC3=CN=CC=C3)C#N)C4=CSC=C4

Isomeric SMILES

C[NH+]1CCC2=C(C1)C(=C(C(=N2)SCC3=CN=CC=C3)C#N)C4=CSC=C4

InChI

InChI=1S/C20H18N4S2/c1-24-7-4-18-17(11-24)19(15-5-8-25-13-15)16(9-21)20(23-18)26-12-14-3-2-6-22-10-14/h2-3,5-6,8,10,13H,4,7,11-12H2,1H3/p+1