2-[(5S)-3-methyl-6-oxidanylidene-1-phenyl-2H-pyrazolo[4,3-b][1,4]thiazin-5-yl]ethanoic acid

Systemtic Name: 2-[(5S)-3-methyl-6-oxidanylidene-1-phenyl-2H-pyrazolo[4,3-b][1,4]thiazin-5-yl]ethanoic acid Openeye Name: 2-[(5S)-3-methyl-6-oxo-1-phenyl-2H-pyrazolo[4,3-b][1,4]thiazin-5-yl]acetic acid CAS Name: 2-[(5S)-3-methyl-6-oxo-1-phenyl-2H-pyrazolo[4,3-b][1,4]thiazin-5-yl]acetic acid IUPAC Name: 2-[(5S)-3-methyl-6-oxo-1-phenyl-2H-pyrazolo[4,3-b][1,4]thiazin-5-yl]acetic acid Traditional Name: 2-[(5S)-6-keto-3-methyl-1-phenyl-2H-pyrazolo[4,3-b][1,4]thiazin-5-yl]acetic acid Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=O)C(S2)CC(=O)O)N(N1)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=NC(=O)[C@@H](S2)CC(=O)O)N(N1)C3=CC=CC=C3

InChI

InChI=1S/C14H13N3O3S/c1-8-12-13(15-14(20)10(21-12)7-11(18)19)17(16-8)9-5-3-2-4-6-9/h2-6,10,16H,7H2,1H3,(H,18,19)/t10-/m0/s1