2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(1-methylpyrazol-4-yl)ethanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(1-methylpyrazol-4-yl)ethanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-methylpyrazol-4-yl)acetamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-methyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-methylpyrazol-4-yl)acetamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(1-methylpyrazol-4-yl)acetamide Formula: C13H13N5O3S MolecularWeight: 319.33902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NC(=O)CNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CN1C=C(C=N1)NC(=O)CNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C13H13N5O3S/c1-18-8-9(6-15-18)16-12(19)7-14-13-10-4-2-3-5-11(10)22(20,21)17-13/h2-6,8H,7H2,1H3,(H,14,17)(H,16,19)