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

Systemtic Name: 4-[(3-methylimidazol-4-yl)methyl-[2-[(phenylmethyl)amino]ethyl]amino]benzenecarbonitrile Openeye Name: 4-[2-(benzylamino)ethyl-[(3-methylimidazol-4-yl)methyl]amino]benzonitrile CAS Name: 4-[(3-methyl-4-imidazolyl)methyl-[2-[(phenylmethyl)amino]ethyl]amino]benzonitrile IUPAC Name: 4-[2-(benzylamino)ethyl-[(3-methylimidazol-4-yl)methyl]amino]benzonitrile Traditional Name: 4-[2-(benzylamino)ethyl-[(3-methylimidazol-4-yl)methyl]amino]benzonitrile Formula: C21H23N5 MolecularWeight: 345.44082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN(CCNCC2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C=NC=C1CN(CCNCC2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H23N5/c1-25-17-24-15-21(25)16-26(20-9-7-18(13-22)8-10-20)12-11-23-14-19-5-3-2-4-6-19/h2-10,15,17,23H,11-12,14,16H2,1H3