3-[(2-methylphenyl)carbamoyl]-[1,2]thiazolo[4,3-d]pyrimidin-7-olate

Systemtic Name: 3-[(2-methylphenyl)carbamoyl]-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Openeye Name: 3-(o-tolylcarbamoyl)isothiazolo[4,3-d]pyrimidin-7-olate CAS Name: 3-[(2-methylanilino)-oxomethyl]-7-isothiazolo[4,3-d]pyrimidinolate IUPAC Name: 3-[(2-methylphenyl)carbamoyl]-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Traditional Name: 3-(o-tolylcarbamoyl)isothiazolo[4,3-d]pyrimidin-7-olate Formula: C13H9N4O2S- MolecularWeight: 285.30116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C3C(=NS2)C(=NC=N3)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C3C(=NS2)C(=NC=N3)[O-]

InChI

InChI=1S/C13H10N4O2S/c1-7-4-2-3-5-8(7)16-13(19)11-9-10(17-20-11)12(18)15-6-14-9/h2-6H,1H3,(H,16,19)(H,14,15,18)/p-1