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

Systemtic Name: N-[3-[2-(2-chloranylphenoxy)ethanoyl-cyclohexyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[[2-(2-chlorophenoxy)acetyl]-cyclohexyl-amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2-(2-chlorophenoxy)-1-oxoethyl]-cyclohexylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[[2-(2-chlorophenoxy)acetyl]-cyclohexylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[[2-(2-chlorophenoxy)acetyl]-cyclohexyl-amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C26H29ClN4O4 MolecularWeight: 496.98586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)COC4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(CC1)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)COC4=CC=CC=C4Cl

InChI

InChI=1S/C26H29ClN4O4/c27-20-12-5-7-14-22(20)35-17-23(32)31(18-9-2-1-3-10-18)16-8-15-28-26(34)24-29-21-13-6-4-11-19(21)25(33)30-24/h4-7,11-14,18H,1-3,8-10,15-17H2,(H,28,34)(H,29,30,33)