(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C14H13N5O3S MolecularWeight: 331.34972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)NC

InChI

InChI=1S/C14H13N5O3S/c1-8-11(12(15-2)23-17-8)14(21)22-7-19-13(20)9-5-3-4-6-10(9)16-18-19/h3-6,15H,7H2,1-2H3