(4-pyrazol-1-ylphenyl)methyl 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-(3-oxo-1,4-benzothiazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-(3-oxo-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid (4-pyrazol-1-ylbenzyl) ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2S1)CC(=O)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2S1)CC(=O)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C20H17N3O3S/c24-19-14-27-18-5-2-1-4-17(18)22(19)12-20(25)26-13-15-6-8-16(9-7-15)23-11-3-10-21-23/h1-11H,12-14H2