2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoic acid; N-phenethyl-2-pyridin-3-yl-ethanamide

Systemtic Name: 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoic acid; N-phenethyl-2-pyridin-3-yl-ethanamide Openeye Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid; N-phenethyl-2-(3-pyridyl)acetamide CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid; N-phenethyl-2-(3-pyridinyl)acetamide IUPAC Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid; N-phenethyl-2-pyridin-3-ylacetamide Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)acetic acid; N-phenethyl-2-(3-pyridyl)acetamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CC2=CN=CC=C2.C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CC2=CN=CC=C2.C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)O

InChI

InChI=1S/C15H16N2O.C10H9NO3S/c18-15(11-14-7-4-9-16-12-14)17-10-8-13-5-2-1-3-6-13;12-9(13)5-8-10(14)11-6-3-1-2-4-7(6)15-8/h1-7,9,12H,8,10-11H2,(H,17,18);1-4,8H,5H2,(H,11,14)(H,12,13)