N-(4-ethoxyphenyl)-2-[3-(4-morpholin-4-ylcarbonylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[3-(4-morpholin-4-ylcarbonylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[3-[4-(morpholine-4-carbonyl)phenyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[3-[4-[4-morpholinyl(oxo)methyl]phenyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[3-[4-(morpholine-4-carbonyl)phenyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-2-yl]thio]-N-p-phenetyl-acetamide Formula: C29H28N4O5S MolecularWeight: 544.62142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)N5CCOCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)N5CCOCC5

InChI

InChI=1S/C29H28N4O5S/c1-2-38-23-13-9-21(10-14-23)30-26(34)19-39-29-31-25-6-4-3-5-24(25)28(36)33(29)22-11-7-20(8-12-22)27(35)32-15-17-37-18-16-32/h3-14H,2,15-19H2,1H3,(H,30,34)