2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4-methylpiperazin-1-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4-methylpiperazin-1-yl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4-methylpiperazin-1-yl)-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4-methyl-1-piperazinyl)-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4-methylpiperazin-1-yl)-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-(4-methylpiperazino)butyronitrile Formula: C16H19N5O MolecularWeight: 297.35496

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)C(=C2NC3=CC=CC=C3N2)C#N

Isomeric SMILES

CN1CCN(CC1)CC(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C16H19N5O/c1-20-6-8-21(9-7-20)11-15(22)12(10-17)16-18-13-4-2-3-5-14(13)19-16/h2-5,18-19H,6-9,11H2,1H3