2-[2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-morpholin-4-ylethyl)-3,6-bis(oxidanylidene)pyrazolo[4,3-c]pyridin-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-morpholin-4-ylethyl)-3,6-bis(oxidanylidene)pyrazolo[4,3-c]pyridin-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-morpholinoethyl)-3,6-dioxo-pyrazolo[4,3-c]pyridin-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[2-(1,3-benzothiazol-2-yl)-4-methyl-5-[2-(4-morpholinyl)ethyl]-3,6-dioxo-1-pyrazolo[4,3-c]pyridinyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-morpholin-4-ylethyl)-3,6-dioxopyrazolo[4,3-c]pyridin-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[2-(1,3-benzothiazol-2-yl)-3,6-diketo-4-methyl-5-(2-morpholinoethyl)pyrazolo[4,3-c]pyridin-1-yl]-N-(4-fluorophenyl)acetamide Formula: C28H27FN6O4S MolecularWeight: 562.615183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=O)N1CCN3CCOCC3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC(=O)NC6=CC=C(C=C6)F

Isomeric SMILES

CC1=C2C(=CC(=O)N1CCN3CCOCC3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC(=O)NC6=CC=C(C=C6)F

InChI

InChI=1S/C28H27FN6O4S/c1-18-26-22(16-25(37)33(18)11-10-32-12-14-39-15-13-32)34(17-24(36)30-20-8-6-19(29)7-9-20)35(27(26)38)28-31-21-4-2-3-5-23(21)40-28/h2-9,16H,10-15,17H2,1H3,(H,30,36)