6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 6-[(4-methoxyphenyl)methylthio]-3,3-dimethyl-8-(4-morpholinyl)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 3,3-dimethyl-8-morpholino-6-(p-anisylthio)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C23H28N3O3S+ MolecularWeight: 426.55172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=[NH+]C(=C2CO1)N3CCOCC3)SCC4=CC=C(C=C4)OC)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=[NH+]C(=C2CO1)N3CCOCC3)SCC4=CC=C(C=C4)OC)C#N)C

InChI

InChI=1S/C23H27N3O3S/c1-23(2)12-18-19(13-24)22(30-15-16-4-6-17(27-3)7-5-16)25-21(20(18)14-29-23)26-8-10-28-11-9-26/h4-7H,8-12,14-15H2,1-3H3/p+1