6-methyl-2-methylsulfanyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile

Systemtic Name: 6-methyl-2-methylsulfanyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile Openeye Name: 6-methyl-2-methylsulfanyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile CAS Name: 6-methyl-2-(methylthio)-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile IUPAC Name: 6-methyl-2-methylsulfanyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile Traditional Name: 6-methyl-2-(methylthio)-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile Formula: C11H15N3S+2 MolecularWeight: 221.3219

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C=C(C(=[NH+]2)SC)C#N

Isomeric SMILES

C[NH+]1CCC2=C(C1)C=C(C(=[NH+]2)SC)C#N

InChI

InChI=1S/C11H13N3S/c1-14-4-3-10-9(7-14)5-8(6-12)11(13-10)15-2/h5H,3-4,7H2,1-2H3/p+2