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

Systemtic Name: N-[2-[2-(3,5-dimethylphenoxy)ethanoylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[2-[[2-(3,5-dimethylphenoxy)acetyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[2-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[2-[[2-(3,5-dimethylphenoxy)acetyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[2-[[2-(3,5-dimethylphenoxy)acetyl]amino]ethyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C

InChI

InChI=1S/C21H22N4O4/c1-13-9-14(2)11-15(10-13)29-12-18(26)22-7-8-23-21(28)19-24-17-6-4-3-5-16(17)20(27)25-19/h3-6,9-11H,7-8,12H2,1-2H3,(H,22,26)(H,23,28)(H,24,25,27)