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

Systemtic Name: 6-chloranyl-2-[2-[4-(1H-indol-4-yl)piperazin-1-yl]ethylsulfanyl]-4-methyl-pyridine-3-carbonitrile Openeye Name: 6-chloro-2-[2-[4-(1H-indol-4-yl)piperazin-1-yl]ethylsulfanyl]-4-methyl-pyridine-3-carbonitrile CAS Name: 6-chloro-2-[2-[4-(1H-indol-4-yl)-1-piperazinyl]ethylthio]-4-methyl-3-pyridinecarbonitrile IUPAC Name: 6-chloro-2-[2-[4-(1H-indol-4-yl)piperazin-1-yl]ethylsulfanyl]-4-methylpyridine-3-carbonitrile Traditional Name: 6-chloro-2-[2-[4-(1H-indol-4-yl)piperazino]ethylthio]-4-methyl-nicotinonitrile Formula: C21H22ClN5S MolecularWeight: 411.95088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCCN2CCN(CC2)C3=CC=CC4=C3C=CN4)Cl

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCCN2CCN(CC2)C3=CC=CC4=C3C=CN4)Cl

InChI

InChI=1S/C21H22ClN5S/c1-15-13-20(22)25-21(17(15)14-23)28-12-11-26-7-9-27(10-8-26)19-4-2-3-18-16(19)5-6-24-18/h2-6,13,24H,7-12H2,1H3