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

Systemtic Name: 2-[4-[(4,6-dimethyl-1H-indol-2-yl)carbonyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(4,6-dimethyl-1H-indole-2-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(4,6-dimethyl-1H-indol-2-yl)-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(4,6-dimethyl-1H-indole-2-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(4,6-dimethyl-1H-indole-2-carbonyl)piperazino]isonicotinonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)N3CCN(CC3)C4=NC=CC(=C4)C#N)C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)N3CCN(CC3)C4=NC=CC(=C4)C#N)C

InChI

InChI=1S/C21H21N5O/c1-14-9-15(2)17-12-19(24-18(17)10-14)21(27)26-7-5-25(6-8-26)20-11-16(13-22)3-4-23-20/h3-4,9-12,24H,5-8H2,1-2H3