8-ethyl-3,3-dimethyl-6-[4-(phenylcarbonyl)piperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 8-ethyl-3,3-dimethyl-6-[4-(phenylcarbonyl)piperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 6-(4-benzoylpiperazin-1-yl)-8-ethyl-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 6-(4-benzoyl-1-piperazinyl)-8-ethyl-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 6-(4-benzoylpiperazin-1-yl)-8-ethyl-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 6-(4-benzoylpiperazino)-8-ethyl-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C24H29N4OS+ MolecularWeight: 421.57826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CSC(CC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)C4=CC=CC=C4)C#N)(C)C

Isomeric SMILES

CCC1=C2CSC(CC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)C4=CC=CC=C4)C#N)(C)C

InChI

InChI=1S/C24H28N4OS/c1-4-21-20-16-30-24(2,3)14-18(20)19(15-25)22(26-21)27-10-12-28(13-11-27)23(29)17-8-6-5-7-9-17/h5-9H,4,10-14,16H2,1-3H3/p+1