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

Systemtic Name: N-[3-[2-(4-tert-butylphenoxy)ethanoyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[benzyl-[2-(4-tert-butylphenoxy)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2-(4-tert-butylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[benzyl-[2-(4-tert-butylphenoxy)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[benzyl-[2-(4-tert-butylphenoxy)acetyl]amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C31H34N4O4 MolecularWeight: 526.62606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H34N4O4/c1-31(2,3)23-14-16-24(17-15-23)39-21-27(36)35(20-22-10-5-4-6-11-22)19-9-18-32-30(38)28-33-26-13-8-7-12-25(26)29(37)34-28/h4-8,10-17H,9,18-21H2,1-3H3,(H,32,38)(H,33,34,37)