2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3-amino-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-[(3-amino-4-oxo-2-quinazolinyl)thio]-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-amino-4-oxoquinazolin-2-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-amino-4-keto-quinazolin-2-yl)thio]-N-(4-morpholinosulfonylphenyl)acetamide Formula: C20H21N5O5S2 MolecularWeight: 475.54124

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3N

InChI

InChI=1S/C20H21N5O5S2/c21-25-19(27)16-3-1-2-4-17(16)23-20(25)31-13-18(26)22-14-5-7-15(8-6-14)32(28,29)24-9-11-30-12-10-24/h1-8H,9-13,21H2,(H,22,26)