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

Systemtic Name: 3,3-dimethyl-8-[4-(phenylcarbonyl)piperazin-1-yl]-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 8-(4-benzoylpiperazin-1-yl)-3,3-dimethyl-6-thioxo-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 8-(4-benzoyl-1-piperazinyl)-3,3-dimethyl-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 8-(4-benzoylpiperazin-1-yl)-3,3-dimethyl-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 8-(4-benzoylpiperazino)-3,3-dimethyl-6-thioxo-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O2S/c1-22(2)12-16-17(13-23)20(29)24-19(18(16)14-28-22)25-8-10-26(11-9-25)21(27)15-6-4-3-5-7-15/h3-7H,8-12,14H2,1-2H3,(H,24,29)