3-[methoxy(phenyl)methyl]-5-(3-methyl-4-oxidanylidene-quinazolin-2-yl)-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one

Systemtic Name: 3-[methoxy(phenyl)methyl]-5-(3-methyl-4-oxidanylidene-quinazolin-2-yl)-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one Openeye Name: 3-[methoxy(phenyl)methyl]-5-(3-methyl-4-oxo-quinazolin-2-yl)-2-oxo-thiadiazolidin-2-ium-4-one CAS Name: 3-[methoxy(phenyl)methyl]-5-(3-methyl-4-oxo-2-quinazolinyl)-2-oxo-4-thiadiazolidin-2-iumone IUPAC Name: 3-[methoxy(phenyl)methyl]-5-(3-methyl-4-oxoquinazolin-2-yl)-2-oxothiadiazolidin-2-ium-4-one Traditional Name: 2-keto-5-(4-keto-3-methyl-quinazolin-2-yl)-3-[methoxy(phenyl)methyl]thiadiazolidin-2-ium-4-one Formula: C19H17N4O4S+ MolecularWeight: 397.42768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)C3C(=O)N([N+](=O)S3)C(C4=CC=CC=C4)OC

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)C3C(=O)N([N+](=O)S3)C(C4=CC=CC=C4)OC

InChI

InChI=1S/C19H17N4O4S/c1-21-16(20-14-11-7-6-10-13(14)17(21)24)15-18(25)22(23(26)28-15)19(27-2)12-8-4-3-5-9-12/h3-11,15,19H,1-2H3/q+1