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

Systemtic Name: N-tert-butyl-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-tert-butyl-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]acetamide CAS Name: N-tert-butyl-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]acetamide IUPAC Name: N-tert-butyl-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]acetamide Traditional Name: N-tert-butyl-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]acetamide Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC2=C(C[NH+](CC2)C)C=C1C#N

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC2=C(C[NH+](CC2)C)C=C1C#N

InChI

InChI=1S/C16H22N4OS/c1-16(2,3)19-14(21)10-22-15-11(8-17)7-12-9-20(4)6-5-13(12)18-15/h7H,5-6,9-10H2,1-4H3,(H,19,21)/p+1