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

Systemtic Name: N-ethyl-N-(3-methylphenyl)-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-ethyl-2-(6-morpholino-4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-N-(m-tolyl)acetamide CAS Name: N-ethyl-N-(3-methylphenyl)-2-[[6-(4-morpholinyl)-4-oxo-3-phenethyl-2-quinazolinyl]thio]acetamide IUPAC Name: N-ethyl-N-(3-methylphenyl)-2-(6-morpholin-4-yl-4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-ethyl-2-[(4-keto-6-morpholino-3-phenethyl-quinazolin-2-yl)thio]-N-(m-tolyl)acetamide Formula: C31H34N4O3S MolecularWeight: 542.69166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CCC5=CC=CC=C5

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CCC5=CC=CC=C5

InChI

InChI=1S/C31H34N4O3S/c1-3-34(26-11-7-8-23(2)20-26)29(36)22-39-31-32-28-13-12-25(33-16-18-38-19-17-33)21-27(28)30(37)35(31)15-14-24-9-5-4-6-10-24/h4-13,20-21H,3,14-19,22H2,1-2H3