N-[3-[3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-[3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[3-(8-methyl-4-oxo-quinazolin-3-yl)propanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[[3-(8-methyl-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[3-(4-keto-8-methyl-quinazolin-3-yl)propanoylamino]phenyl]-piperonylamide Formula: C26H22N4O5 MolecularWeight: 470.47668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=CC(=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=CC(=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H22N4O5/c1-16-4-2-7-20-24(16)27-14-30(26(20)33)11-10-23(31)28-18-5-3-6-19(13-18)29-25(32)17-8-9-21-22(12-17)35-15-34-21/h2-9,12-14H,10-11,15H2,1H3,(H,28,31)(H,29,32)