3-[[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-phenyl-amino]propanenitrile

Systemtic Name: 3-[[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-phenyl-amino]propanenitrile Openeye Name: 3-(N-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]anilino)propanenitrile CAS Name: 3-(N-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]anilino)propanenitrile IUPAC Name: 3-(N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]anilino)propanenitrile Traditional Name: 3-(N-[2-keto-2-(4-methylpiperazino)ethyl]anilino)propionitrile Formula: C16H22N4O MolecularWeight: 286.37208

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CN(CCC#N)C2=CC=CC=C2

Isomeric SMILES

CN1CCN(CC1)C(=O)CN(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C16H22N4O/c1-18-10-12-19(13-11-18)16(21)14-20(9-5-8-17)15-6-3-2-4-7-15/h2-4,6-7H,5,9-14H2,1H3