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

Systemtic Name: 3-[[2-azanyl-3-(4-methylpiperazin-1-yl)phenyl]amino]propanenitrile Openeye Name: 3-[2-amino-3-(4-methylpiperazin-1-yl)anilino]propanenitrile CAS Name: 3-[2-amino-3-(4-methyl-1-piperazinyl)anilino]propanenitrile IUPAC Name: 3-[2-amino-3-(4-methylpiperazin-1-yl)anilino]propanenitrile Traditional Name: 3-[2-amino-3-(4-methylpiperazino)anilino]propionitrile Formula: C14H21N5 MolecularWeight: 259.35004

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=CC=C2)NCCC#N)N

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=CC=C2)NCCC#N)N

InChI

InChI=1S/C14H21N5/c1-18-8-10-19(11-9-18)13-5-2-4-12(14(13)16)17-7-3-6-15/h2,4-5,17H,3,7-11,16H2,1H3