4-[(3-methylimidazol-4-yl)methyl-[2-(2-methylprop-2-enylamino)ethyl]amino]benzenecarbonitrile

Systemtic Name: 4-[(3-methylimidazol-4-yl)methyl-[2-(2-methylprop-2-enylamino)ethyl]amino]benzenecarbonitrile Openeye Name: 4-[2-(2-methylallylamino)ethyl-[(3-methylimidazol-4-yl)methyl]amino]benzonitrile CAS Name: 4-[(3-methyl-4-imidazolyl)methyl-[2-(2-methylprop-2-enylamino)ethyl]amino]benzonitrile IUPAC Name: 4-[(3-methylimidazol-4-yl)methyl-[2-(2-methylprop-2-enylamino)ethyl]amino]benzonitrile Traditional Name: 4-[2-(2-methylallylamino)ethyl-[(3-methylimidazol-4-yl)methyl]amino]benzonitrile Formula: C18H23N5 MolecularWeight: 309.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNCCN(CC1=CN=CN1C)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(=C)CNCCN(CC1=CN=CN1C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H23N5/c1-15(2)11-20-8-9-23(13-18-12-21-14-22(18)3)17-6-4-16(10-19)5-7-17/h4-7,12,14,20H,1,8-9,11,13H2,2-3H3