N-[3-[cyclohexyl-[2-(3,5-dimethylphenoxy)ethanoyl]amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[cyclohexyl-[2-(3,5-dimethylphenoxy)ethanoyl]amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[cyclohexyl-[2-(3,5-dimethylphenoxy)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[cyclohexyl-[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[cyclohexyl-[2-(3,5-dimethylphenoxy)acetyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[cyclohexyl-[2-(3,5-dimethylphenoxy)acetyl]amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C28H34N4O4 MolecularWeight: 490.59396

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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)C4CCCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4)C

InChI

InChI=1S/C28H34N4O4/c1-19-15-20(2)17-22(16-19)36-18-25(33)32(21-9-4-3-5-10-21)14-8-13-29-28(35)26-30-24-12-7-6-11-23(24)27(34)31-26/h6-7,11-12,15-17,21H,3-5,8-10,13-14,18H2,1-2H3,(H,29,35)(H,30,31,34)