N-(1,3-benzothiazol-2-yl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[4-methyl-3-(1-methylsulfonyl-4-piperidyl)-5-oxo-1,2,4-triazol-1-yl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[4-methyl-3-(1-methylsulfonyl-4-piperidinyl)-5-oxo-1,2,4-triazol-1-yl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxo-1,2,4-triazol-1-yl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[5-keto-3-(1-mesyl-4-piperidyl)-4-methyl-1,2,4-triazol-1-yl]acetamide Formula: C18H22N6O4S2 MolecularWeight: 450.53508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=O)CC(=O)NC2=NC3=CC=CC=C3S2)C4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CN1C(=NN(C1=O)CC(=O)NC2=NC3=CC=CC=C3S2)C4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C18H22N6O4S2/c1-22-16(12-7-9-23(10-8-12)30(2,27)28)21-24(18(22)26)11-15(25)20-17-19-13-5-3-4-6-14(13)29-17/h3-6,12H,7-11H2,1-2H3,(H,19,20,25)