(E)-3-[4-[(4-methylphenyl)methoxy]phenyl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[4-[(4-methylphenyl)methoxy]phenyl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-[4-(p-tolylmethoxy)phenyl]prop-2-enenitrile CAS Name: (E)-3-[4-[(4-methylphenyl)methoxy]phenyl]-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-[4-[(4-methylphenyl)methoxy]phenyl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-keto-1H-quinazolin-2-yl)-3-[4-(4-methylbenzyl)oxyphenyl]acrylonitrile Formula: C25H19N3O2 MolecularWeight: 393.43726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C(\C#N)/C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H19N3O2/c1-17-6-8-19(9-7-17)16-30-21-12-10-18(11-13-21)14-20(15-26)24-27-23-5-3-2-4-22(23)25(29)28-24/h2-14H,16H2,1H3,(H,27,28,29)/b20-14+