2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)ethanamide Openeye Name: 2-(3-amino-4-oxo-quinazolin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[(3-amino-4-oxo-2-quinazolinyl)thio]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-(3-amino-4-oxoquinazolin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-[(3-amino-4-keto-quinazolin-2-yl)thio]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3N

InChI

InChI=1S/C17H14N4O4S/c18-21-16(23)11-3-1-2-4-12(11)20-17(21)26-8-15(22)19-10-5-6-13-14(7-10)25-9-24-13/h1-7H,8-9,18H2,(H,19,22)