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

Systemtic Name: 2-ethylsulfanyl-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile Openeye Name: 2-ethylsulfanyl-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile CAS Name: 2-(ethylthio)-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile IUPAC Name: 2-ethylsulfanyl-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile Traditional Name: 2-(ethylthio)-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-1,6-diium-3-carbonitrile Formula: C12H17N3S+2 MolecularWeight: 235.34848

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=[NH+]C2=C(C[NH+](CC2)C)C=C1C#N

Isomeric SMILES

CCSC1=[NH+]C2=C(C[NH+](CC2)C)C=C1C#N

InChI

InChI=1S/C12H15N3S/c1-3-16-12-9(7-13)6-10-8-15(2)5-4-11(10)14-12/h6H,3-5,8H2,1-2H3/p+2