3-(methoxycarbothioylamino)-4-oxidanylidene-quinolizine-1-carboxylic acid

Systemtic Name: 3-(methoxycarbothioylamino)-4-oxidanylidene-quinolizine-1-carboxylic acid Openeye Name: 3-(methoxycarbothioylamino)-4-oxo-quinolizine-1-carboxylic acid CAS Name: 3-[[methoxy(sulfanylidene)methyl]amino]-4-oxo-1-quinolizinecarboxylic acid IUPAC Name: 3-(methoxycarbothioylamino)-4-oxoquinolizine-1-carboxylic acid Traditional Name: 4-keto-3-(methoxycarbothioylamino)quinolizine-1-carboxylic acid Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)NC1=CC(=C2C=CC=CN2C1=O)C(=O)O

Isomeric SMILES

COC(=S)NC1=CC(=C2C=CC=CN2C1=O)C(=O)O

InChI

InChI=1S/C12H10N2O4S/c1-18-12(19)13-8-6-7(11(16)17)9-4-2-3-5-14(9)10(8)15/h2-6H,1H3,(H,13,19)(H,16,17)