4-butyl-N-[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl]benzamide

Systemtic Name: 4-butyl-N-[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl]benzamide Openeye Name: 4-butyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-quinazolin-3-yl]benzamide CAS Name: 4-butyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-3-quinazolinyl]benzamide IUPAC Name: 4-butyl-N-[2-(3,4-dimethoxyphenyl)-4-oxoquinazolin-3-yl]benzamide Traditional Name: 4-butyl-N-[2-(3,4-dimethoxyphenyl)-4-keto-quinazolin-3-yl]benzamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H27N3O4/c1-4-5-8-18-11-13-19(14-12-18)26(31)29-30-25(20-15-16-23(33-2)24(17-20)34-3)28-22-10-7-6-9-21(22)27(30)32/h6-7,9-17H,4-5,8H2,1-3H3,(H,29,31)