2-[4-(4-methylphenyl)-5-morpholin-4-yl-4,5-dihydro-1,2,3-triazol-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(4-methylphenyl)-5-morpholin-4-yl-4,5-dihydro-1,2,3-triazol-1-yl]benzenecarbonitrile Openeye Name: 2-[5-morpholino-4-(p-tolyl)-4,5-dihydrotriazol-1-yl]benzonitrile CAS Name: 2-[4-(4-methylphenyl)-5-(4-morpholinyl)-4,5-dihydrotriazol-1-yl]benzonitrile IUPAC Name: 2-[4-(4-methylphenyl)-5-morpholin-4-yl-4,5-dihydrotriazol-1-yl]benzonitrile Traditional Name: 2-[5-morpholino-4-(p-tolyl)-4,5-dihydrotriazol-1-yl]benzonitrile Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(N(N=N2)C3=CC=CC=C3C#N)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2C(N(N=N2)C3=CC=CC=C3C#N)N4CCOCC4

InChI

InChI=1S/C20H21N5O/c1-15-6-8-16(9-7-15)19-20(24-10-12-26-13-11-24)25(23-22-19)18-5-3-2-4-17(18)14-21/h2-9,19-20H,10-13H2,1H3