3-[(4-methoxyphenyl)methyl]-7-morpholin-4-ylcarbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-7-morpholin-4-ylcarbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(4-methoxyphenyl)methyl]-7-(morpholine-4-carbonyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(4-methoxyphenyl)methyl]-7-[4-morpholinyl(oxo)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(4-methoxyphenyl)methyl]-7-(morpholine-4-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(morpholine-4-carbonyl)-3-p-anisyl-2-thioxo-1H-quinazolin-4-one Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)NC2=S

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)NC2=S

InChI

InChI=1S/C21H21N3O4S/c1-27-16-5-2-14(3-6-16)13-24-20(26)17-7-4-15(12-18(17)22-21(24)29)19(25)23-8-10-28-11-9-23/h2-7,12H,8-11,13H2,1H3,(H,22,29)