N-[3-[2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[benzyl(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-(phenylmethyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[benzyl(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[benzyl(2,3-dihydro-1,4-benzodioxin-6-carbonyl)amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C28H26N4O5 MolecularWeight: 498.52984

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)N(CCCNC(=O)C3=NC(=O)C4=CC=CC=C4N3)CC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)N(CCCNC(=O)C3=NC(=O)C4=CC=CC=C4N3)CC5=CC=CC=C5

InChI

InChI=1S/C28H26N4O5/c33-26-21-9-4-5-10-22(21)30-25(31-26)27(34)29-13-6-14-32(18-19-7-2-1-3-8-19)28(35)20-11-12-23-24(17-20)37-16-15-36-23/h1-5,7-12,17H,6,13-16,18H2,(H,29,34)(H,30,31,33)