N-cyclohexyl-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-(6-morpholino-4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[6-(4-morpholinyl)-4-oxo-3-phenethyl-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-(6-morpholin-4-yl-4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-cyclohexyl-2-[(4-keto-6-morpholino-3-phenethyl-quinazolin-2-yl)thio]acetamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CCC5=CC=CC=C5

InChI

InChI=1S/C28H34N4O3S/c33-26(29-22-9-5-2-6-10-22)20-36-28-30-25-12-11-23(31-15-17-35-18-16-31)19-24(25)27(34)32(28)14-13-21-7-3-1-4-8-21/h1,3-4,7-8,11-12,19,22H,2,5-6,9-10,13-18,20H2,(H,29,33)