(E)-3-(2-methoxy-5-methyl-phenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-(2-methoxy-5-methyl-phenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]prop-2-enamide CAS Name: (E)-3-(2-methoxy-5-methylphenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-(2-methoxy-5-methylphenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]prop-2-enamide Traditional Name: (E)-N-benzyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-3-(2-methoxy-5-methyl-phenyl)acrylamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C27H25N3O3/c1-19-12-14-24(33-2)21(16-19)13-15-26(31)30(17-20-8-4-3-5-9-20)18-25-28-23-11-7-6-10-22(23)27(32)29-25/h3-16H,17-18H2,1-2H3,(H,28,29,32)/b15-13+