N-[3-[2-(3-methylphenoxy)ethanoyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[2-(3-methylphenoxy)ethanoyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[benzyl-[2-(3-methylphenoxy)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2-(3-methylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[benzyl-[2-(3-methylphenoxy)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[benzyl-[2-(3-methylphenoxy)acetyl]amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)CC4=CC=CC=C4

InChI

InChI=1S/C28H28N4O4/c1-20-9-7-12-22(17-20)36-19-25(33)32(18-21-10-3-2-4-11-21)16-8-15-29-28(35)26-30-24-14-6-5-13-23(24)27(34)31-26/h2-7,9-14,17H,8,15-16,18-19H2,1H3,(H,29,35)(H,30,31,34)