N-(3-methylbutyl)-N-[1-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-phenyl-prop-2-enamide

Systemtic Name: N-(3-methylbutyl)-N-[1-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-phenyl-prop-2-enamide Openeye Name: N-isopentyl-N-[1-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]ethyl]-3-phenyl-prop-2-enamide CAS Name: N-(3-methylbutyl)-N-[1-[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-phenyl-2-propenamide IUPAC Name: N-(3-methylbutyl)-N-[1-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-phenylprop-2-enamide Traditional Name: N-isoamyl-N-[1-[4-keto-3-(o-tolyl)quinazolin-2-yl]ethyl]-3-phenyl-acrylamide Formula: C31H33N3O2 MolecularWeight: 479.61262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)C(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C31H33N3O2/c1-22(2)20-21-33(29(35)19-18-25-13-6-5-7-14-25)24(4)30-32-27-16-10-9-15-26(27)31(36)34(30)28-17-11-8-12-23(28)3/h5-19,22,24H,20-21H2,1-4H3