2-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: N-(4-morpholinophenyl)-2-[3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[[4-keto-3-(m-tolyl)quinazolin-2-yl]thio]-N-(4-morpholinophenyl)acetamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C27H26N4O3S/c1-19-5-4-6-22(17-19)31-26(33)23-7-2-3-8-24(23)29-27(31)35-18-25(32)28-20-9-11-21(12-10-20)30-13-15-34-16-14-30/h2-12,17H,13-16,18H2,1H3,(H,28,32)