(E)-3-(4-tert-butylphenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(oxolan-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(oxolan-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-(2-oxolanylmethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-propenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-(oxolan-2-ylmethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]prop-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(tetrahydrofurfuryl)acrylamide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)N(CC2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)N(CC2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C27H31N3O3/c1-27(2,3)20-13-10-19(11-14-20)12-15-25(31)30(17-21-7-6-16-33-21)18-24-28-23-9-5-4-8-22(23)26(32)29-24/h4-5,8-15,21H,6-7,16-18H2,1-3H3,(H,28,29,32)/b15-12+