3-(6-azanyl-5-cyano-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridin-7-yl)propyl-dimethyl-azanium

Systemtic Name: 3-(6-azanyl-5-cyano-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridin-7-yl)propyl-dimethyl-azanium Openeye Name: 3-(6-amino-5-cyano-3,3-dimethyl-8-thioxo-1,4-dihydropyrano[3,4-c]pyridin-7-yl)propyl-dimethyl-ammonium CAS Name: 3-(6-amino-5-cyano-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridin-7-yl)propyl-dimethylammonium IUPAC Name: 3-(6-amino-5-cyano-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridin-7-yl)propyl-dimethylazanium Traditional Name: 3-(6-amino-5-cyano-3,3-dimethyl-8-thioxo-1,4-dihydropyrano[3,4-c]pyridin-7-yl)propyl-dimethyl-ammonium Formula: C16H25N4OS+ MolecularWeight: 321.4609

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)C(=S)N(C(=C2C#N)N)CCC[NH+](C)C)C

Isomeric SMILES

CC1(CC2=C(CO1)C(=S)N(C(=C2C#N)N)CCC[NH+](C)C)C

InChI

InChI=1S/C16H24N4OS/c1-16(2)8-11-12(9-17)14(18)20(7-5-6-19(3)4)15(22)13(11)10-21-16/h5-8,10,18H2,1-4H3/p+1