2-ethylsulfanyl-5-[4-(1H-indol-4-yl)piperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyridine-3-carbonitrile

Systemtic Name: 2-ethylsulfanyl-5-[4-(1H-indol-4-yl)piperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyridine-3-carbonitrile Openeye Name: 2-ethylsulfanyl-5-[4-(1H-indol-4-yl)piperazin-1-yl]-4-methyl-6-(1-piperidyl)pyridine-3-carbonitrile CAS Name: 2-(ethylthio)-5-[4-(1H-indol-4-yl)-1-piperazinyl]-4-methyl-6-(1-piperidinyl)-3-pyridinecarbonitrile IUPAC Name: 2-ethylsulfanyl-5-[4-(1H-indol-4-yl)piperazin-1-yl]-4-methyl-6-piperidin-1-ylpyridine-3-carbonitrile Traditional Name: 2-(ethylthio)-5-[4-(1H-indol-4-yl)piperazino]-4-methyl-6-piperidino-nicotinonitrile Formula: C26H32N6S MolecularWeight: 460.63748

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=C(C(=C1C#N)C)N2CCN(CC2)C3=CC=CC4=C3C=CN4)N5CCCCC5

Isomeric SMILES

CCSC1=NC(=C(C(=C1C#N)C)N2CCN(CC2)C3=CC=CC4=C3C=CN4)N5CCCCC5

InChI

InChI=1S/C26H32N6S/c1-3-33-26-21(18-27)19(2)24(25(29-26)32-12-5-4-6-13-32)31-16-14-30(15-17-31)23-9-7-8-22-20(23)10-11-28-22/h7-11,28H,3-6,12-17H2,1-2H3