3,3-dimethyl-8-[4-(2-phenylethanoyl)piperazin-1-yl]-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile

Systemtic Name: 3,3-dimethyl-8-[4-(2-phenylethanoyl)piperazin-1-yl]-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 3,3-dimethyl-8-[4-(2-phenylacetyl)piperazin-1-yl]-6-thioxo-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 3,3-dimethyl-8-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 3,3-dimethyl-8-[4-(2-phenylacetyl)piperazin-1-yl]-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 3,3-dimethyl-8-[4-(2-phenylacetyl)piperazino]-6-thioxo-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=S)NC(=C2CO1)N3CCN(CC3)C(=O)CC4=CC=CC=C4)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=S)NC(=C2CO1)N3CCN(CC3)C(=O)CC4=CC=CC=C4)C#N)C

InChI

InChI=1S/C23H26N4O2S/c1-23(2)13-17-18(14-24)22(30)25-21(19(17)15-29-23)27-10-8-26(9-11-27)20(28)12-16-6-4-3-5-7-16/h3-7H,8-13,15H2,1-2H3,(H,25,30)