2-[4-[(2S)-3-[(4-methylphenyl)methyl]-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(2S)-3-[(4-methylphenyl)methyl]-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(2S)-4-oxo-3-(p-tolylmethyl)-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile CAS Name: 2-[4-[(2S)-3-[(4-methylphenyl)methyl]-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(2S)-3-[(4-methylphenyl)methyl]-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile Traditional Name: 2-[4-[(2S)-4-keto-3-(4-methylbenzyl)-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile Formula: C24H21N3O2 MolecularWeight: 383.44244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OCC#N

Isomeric SMILES

CC1=CC=C(C=C1)CN2[C@H](NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OCC#N

InChI

InChI=1S/C24H21N3O2/c1-17-6-8-18(9-7-17)16-27-23(19-10-12-20(13-11-19)29-15-14-25)26-22-5-3-2-4-21(22)24(27)28/h2-13,23,26H,15-16H2,1H3/t23-/m0/s1