N-ethyl-1-[3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]cyclohexane-1-carboxamide

Systemtic Name: N-ethyl-1-[3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]cyclohexane-1-carboxamide Openeye Name: N-ethyl-1-[3-(8-methyl-4-oxo-quinazolin-3-yl)propanoylamino]cyclohexanecarboxamide CAS Name: N-ethyl-1-[[3-(8-methyl-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]-1-cyclohexanecarboxamide IUPAC Name: N-ethyl-1-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoylamino]cyclohexane-1-carboxamide Traditional Name: N-ethyl-1-[3-(4-keto-8-methyl-quinazolin-3-yl)propanoylamino]cyclohexanecarboxamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1(CCCCC1)NC(=O)CCN2C=NC3=C(C2=O)C=CC=C3C

Isomeric SMILES

CCNC(=O)C1(CCCCC1)NC(=O)CCN2C=NC3=C(C2=O)C=CC=C3C

InChI

InChI=1S/C21H28N4O3/c1-3-22-20(28)21(11-5-4-6-12-21)24-17(26)10-13-25-14-23-18-15(2)8-7-9-16(18)19(25)27/h7-9,14H,3-6,10-13H2,1-2H3,(H,22,28)(H,24,26)