7-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]carbamoyl]-3-ethyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]carbamoyl]-3-ethyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-[[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]carbamoyl]-3-ethyl-2-thioxo-quinazolin-4-olate CAS Name: 7-[[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]hydrazo]-oxomethyl]-3-ethyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]carbamoyl]-3-ethyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]carbamoyl]-3-ethyl-2-thioxo-quinazolin-4-olate Formula: C20H17N4O5S- MolecularWeight: 425.43778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NNC(=O)C3COC4=CC=CC=C4O3)[O-]

Isomeric SMILES

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NNC(=O)[C@H]3COC4=CC=CC=C4O3)[O-]

InChI

InChI=1S/C20H18N4O5S/c1-2-24-19(27)12-8-7-11(9-13(12)21-20(24)30)17(25)22-23-18(26)16-10-28-14-5-3-4-6-15(14)29-16/h3-9,16,27H,2,10H2,1H3,(H,22,25)(H,23,26)/p-1/t16-/m1/s1