6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile

Systemtic Name: 6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholino-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 6-[(4-methoxyphenyl)methylthio]-3,3-dimethyl-8-(4-morpholinyl)-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 6-[(4-methoxyphenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 3,3-dimethyl-8-morpholino-6-(p-anisylthio)-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=NC(=C2CS1)N3CCOCC3)SCC4=CC=C(C=C4)OC)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=NC(=C2CS1)N3CCOCC3)SCC4=CC=C(C=C4)OC)C#N)C

InChI

InChI=1S/C23H27N3O2S2/c1-23(2)12-18-19(13-24)22(29-14-16-4-6-17(27-3)7-5-16)25-21(20(18)15-30-23)26-8-10-28-11-9-26/h4-7H,8-12,14-15H2,1-3H3