3-[(3-ethoxyphenyl)carbamoyl]-5-methyl-[1,2]thiazolo[4,3-d]pyrimidin-7-olate

Systemtic Name: 3-[(3-ethoxyphenyl)carbamoyl]-5-methyl-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Openeye Name: 3-[(3-ethoxyphenyl)carbamoyl]-5-methyl-isothiazolo[4,3-d]pyrimidin-7-olate CAS Name: 3-[(3-ethoxyanilino)-oxomethyl]-5-methyl-7-isothiazolo[4,3-d]pyrimidinolate IUPAC Name: 3-[(3-ethoxyphenyl)carbamoyl]-5-methyl-[1,2]thiazolo[4,3-d]pyrimidin-7-olate Traditional Name: 5-methyl-3-(m-phenetylcarbamoyl)isothiazolo[4,3-d]pyrimidin-7-olate Formula: C15H13N4O3S- MolecularWeight: 329.35372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2=C3C(=NS2)C(=NC(=N3)C)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C2=C3C(=NS2)C(=NC(=N3)C)[O-]

InChI

InChI=1S/C15H14N4O3S/c1-3-22-10-6-4-5-9(7-10)18-15(21)13-11-12(19-23-13)14(20)17-8(2)16-11/h4-7H,3H2,1-2H3,(H,18,21)(H,16,17,20)/p-1