N-[3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[[2-(4-chloro-3-methyl-phenoxy)acetyl]-methyl-amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[[2-(4-chloro-3-methylphenoxy)acetyl]-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[[2-(4-chloro-3-methyl-phenoxy)acetyl]-methyl-amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C22H23ClN4O4 MolecularWeight: 442.89542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)N(C)CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N(C)CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)Cl

InChI

InChI=1S/C22H23ClN4O4/c1-14-12-15(8-9-17(14)23)31-13-19(28)27(2)11-5-10-24-22(30)20-25-18-7-4-3-6-16(18)21(29)26-20/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,24,30)(H,25,26,29)