4-(4-chlorophenyl)-3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-thiolate

Systemtic Name: 4-(4-chlorophenyl)-3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-thiolate Openeye Name: 4-(4-chlorophenyl)-3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-thiolate CAS Name: 4-(4-chlorophenyl)-3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-thiolate IUPAC Name: 4-(4-chlorophenyl)-3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-thiolate Traditional Name: 4-(4-chlorophenyl)-3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-thiolate Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C(=C(C(=N2)[S-])C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCC2=C(C1)C(=C(C(=N2)[S-])C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3S/c1-20-7-6-14-13(9-20)15(12(8-18)16(21)19-14)10-2-4-11(17)5-3-10/h2-5H,6-7,9H2,1H3,(H,19,21)