N-[2-[(3,5-dimethoxyphenyl)carbonylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[2-[(3,5-dimethoxyphenyl)carbonylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[2-[(3,5-dimethoxybenzoyl)amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[2-[(3,5-dimethoxybenzoyl)amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[2-[(3,5-dimethoxybenzoyl)amino]ethyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)OC

InChI

InChI=1S/C20H20N4O5/c1-28-13-9-12(10-14(11-13)29-2)18(25)21-7-8-22-20(27)17-23-16-6-4-3-5-15(16)19(26)24-17/h3-6,9-11H,7-8H2,1-2H3,(H,21,25)(H,22,27)(H,23,24,26)