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

Systemtic Name: 6-[(3,4-dichlorophenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 6-[(3,4-dichlorophenyl)methylsulfanyl]-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 6-[(3,4-dichlorophenyl)methylthio]-3,3-dimethyl-8-(4-morpholinyl)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 6-[(3,4-dichlorophenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 6-[(3,4-dichlorobenzyl)thio]-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Formula: C22H23Cl2N3O2S MolecularWeight: 464.40792

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=NC(=C2CO1)N3CCOCC3)SCC4=CC(=C(C=C4)Cl)Cl)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=NC(=C2CO1)N3CCOCC3)SCC4=CC(=C(C=C4)Cl)Cl)C#N)C

InChI

InChI=1S/C22H23Cl2N3O2S/c1-22(2)10-15-16(11-25)21(30-13-14-3-4-18(23)19(24)9-14)26-20(17(15)12-29-22)27-5-7-28-8-6-27/h3-4,9H,5-8,10,12-13H2,1-2H3