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

Systemtic Name: N-(4-dimethylaminophenyl)-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-dimethylaminophenyl)-2-(6-morpholino-4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-dimethylaminophenyl)-2-[[6-(4-morpholinyl)-4-oxo-3-phenethyl-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-dimethylaminophenyl)-2-(6-morpholin-4-yl-4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-dimethylaminophenyl)-2-[(4-keto-6-morpholino-3-phenethyl-quinazolin-2-yl)thio]acetamide Formula: C30H33N5O3S MolecularWeight: 543.67972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H33N5O3S/c1-33(2)24-10-8-23(9-11-24)31-28(36)21-39-30-32-27-13-12-25(34-16-18-38-19-17-34)20-26(27)29(37)35(30)15-14-22-6-4-3-5-7-22/h3-13,20H,14-19,21H2,1-2H3,(H,31,36)