5-[4-(1H-indol-4-yl)piperazin-1-yl]-4,6-dimethyl-2-propylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 5-[4-(1H-indol-4-yl)piperazin-1-yl]-4,6-dimethyl-2-propylsulfanyl-pyridine-3-carbonitrile Openeye Name: 5-[4-(1H-indol-4-yl)piperazin-1-yl]-4,6-dimethyl-2-propylsulfanyl-pyridine-3-carbonitrile CAS Name: 5-[4-(1H-indol-4-yl)-1-piperazinyl]-4,6-dimethyl-2-(propylthio)-3-pyridinecarbonitrile IUPAC Name: 5-[4-(1H-indol-4-yl)piperazin-1-yl]-4,6-dimethyl-2-propylsulfanylpyridine-3-carbonitrile Traditional Name: 5-[4-(1H-indol-4-yl)piperazino]-4,6-dimethyl-2-(propylthio)nicotinonitrile Formula: C23H27N5S MolecularWeight: 405.55898

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(C(=C1C#N)C)N2CCN(CC2)C3=CC=CC4=C3C=CN4)C

Isomeric SMILES

CCCSC1=NC(=C(C(=C1C#N)C)N2CCN(CC2)C3=CC=CC4=C3C=CN4)C

InChI

InChI=1S/C23H27N5S/c1-4-14-29-23-19(15-24)16(2)22(17(3)26-23)28-12-10-27(11-13-28)21-7-5-6-20-18(21)8-9-25-20/h5-9,25H,4,10-14H2,1-3H3