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2-[[3-cyano-6-(phenylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl]sulfanyl]ethanamide

2-[[3-cyano-6-(phenylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl]sulfanyl]ethanamide

Systemtic Name:2-[[3-cyano-6-(phenylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl]sulfanyl]ethanamide
Openeye Name:2-[(6-benzyl-3-cyano-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]acetamide
CAS Name:2-[[3-cyano-6-(phenylmethyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl]thio]acetamide
IUPAC Name:2-[(6-benzyl-3-cyano-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]acetamide
Traditional Name:2-[(6-benzyl-3-cyano-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]acetamide
Formula: C18H19N4OS+
MolecularWeight: 339.43466
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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1N=C(C(=C2)C#N)SCC(=O)N)CC3=CC=CC=C3


Isomeric SMILES

C1C[NH+](CC2=C1N=C(C(=C2)C#N)SCC(=O)N)CC3=CC=CC=C3


InChI

InChI=1S/C18H18N4OS/c19-9-14-8-15-11-22(10-13-4-2-1-3-5-13)7-6-16(15)21-18(14)24-12-17(20)23/h1-5,8H,6-7,10-12H2,(H2,20,23)/p+1


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