3-ethyl-7-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-ethyl-7-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-ethyl-7-[(3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 3-ethyl-7-[oxo-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]methyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-ethyl-7-[(3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-ethyl-7-[(3-keto-4H-1,4-benzoxazin-6-yl)carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C19H15N4O4S- MolecularWeight: 395.4118

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC4=C(C=C3)OCC(=O)N4)[O-]

Isomeric SMILES

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC4=C(C=C3)OCC(=O)N4)[O-]

InChI

InChI=1S/C19H16N4O4S/c1-2-23-18(26)12-5-3-10(7-13(12)22-19(23)28)17(25)20-11-4-6-15-14(8-11)21-16(24)9-27-15/h3-8,26H,2,9H2,1H3,(H,20,25)(H,21,24)/p-1