N-(4-morpholin-4-ylphenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-morpholinophenyl)-3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[4-(4-morpholinyl)phenyl]-3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-3-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 3-[(4-keto-3-phenyl-quinazolin-2-yl)thio]-N-(4-morpholinophenyl)propionamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)CCSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)CCSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3S/c32-25(28-20-10-12-21(13-11-20)30-15-17-34-18-16-30)14-19-35-27-29-24-9-5-4-8-23(24)26(33)31(27)22-6-2-1-3-7-22/h1-13H,14-19H2,(H,28,32)