6-azanyl-3,3-dimethyl-7-[(4-propan-2-yloxyphenyl)methyl]-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile

Systemtic Name: 6-azanyl-3,3-dimethyl-7-[(4-propan-2-yloxyphenyl)methyl]-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 6-amino-7-[(4-isopropoxyphenyl)methyl]-3,3-dimethyl-8-thioxo-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 6-amino-3,3-dimethyl-7-[(4-propan-2-yloxyphenyl)methyl]-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 6-amino-3,3-dimethyl-7-[(4-propan-2-yloxyphenyl)methyl]-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 6-amino-7-(4-isopropoxybenzyl)-3,3-dimethyl-8-thioxo-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CN2C(=C(C3=C(C2=S)COC(C3)(C)C)C#N)N

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CN2C(=C(C3=C(C2=S)COC(C3)(C)C)C#N)N

InChI

InChI=1S/C21H25N3O2S/c1-13(2)26-15-7-5-14(6-8-15)11-24-19(23)17(10-22)16-9-21(3,4)25-12-18(16)20(24)27/h5-8,13H,9,11-12,23H2,1-4H3