N-(3-methoxypropyl)-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(3-methoxypropyl)-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-butanamide Openeye Name: N-(3-methoxypropyl)-2-(6-morpholino-4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-butanamide CAS Name: N-(3-methoxypropyl)-2-[[6-(4-morpholinyl)-4-oxo-3-phenethyl-2-quinazolinyl]thio]butanamide IUPAC Name: N-(3-methoxypropyl)-2-(6-morpholin-4-yl-4-oxo-3-phenethylquinazolin-2-yl)sulfanylbutanamide Traditional Name: 2-[(4-keto-6-morpholino-3-phenethyl-quinazolin-2-yl)thio]-N-(3-methoxypropyl)butyramide Formula: C28H36N4O4S MolecularWeight: 524.67484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCCOC)SC1=NC2=C(C=C(C=C2)N3CCOCC3)C(=O)N1CCC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NCCCOC)SC1=NC2=C(C=C(C=C2)N3CCOCC3)C(=O)N1CCC4=CC=CC=C4

InChI

InChI=1S/C28H36N4O4S/c1-3-25(26(33)29-13-7-17-35-2)37-28-30-24-11-10-22(31-15-18-36-19-16-31)20-23(24)27(34)32(28)14-12-21-8-5-4-6-9-21/h4-6,8-11,20,25H,3,7,12-19H2,1-2H3,(H,29,33)