3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(3-oxidanylpyridin-2-yl)propanamide

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(3-oxidanylpyridin-2-yl)propanamide Openeye Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(3-hydroxy-2-pyridyl)propanamide CAS Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(3-hydroxy-2-pyridinyl)propanamide IUPAC Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(3-hydroxypyridin-2-yl)propanamide Traditional Name: 3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(3-hydroxy-2-pyridyl)propionamide Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCC(=O)NC3=C(C=CC=N3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCC(=O)NC3=C(C=CC=N3)O

InChI

InChI=1S/C15H14N4O4S/c20-11-5-3-8-16-15(11)18-13(21)7-9-17-14-10-4-1-2-6-12(10)24(22,23)19-14/h1-6,8,20H,7,9H2,(H,17,19)(H,16,18,21)