(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[2-(3-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-pyridinyl)-4-thiazolyl]acetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(3-pyridyl)thiazol-4-yl]acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C18H13N5O3S MolecularWeight: 379.39252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CC3=CSC(=N3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CC3=CSC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C18H13N5O3S/c24-16(8-13-10-27-17(20-13)12-4-3-7-19-9-12)26-11-23-18(25)14-5-1-2-6-15(14)21-22-23/h1-7,9-10H,8,11H2