Vitas-M small molecule compound
2-[2-(1,3-benzothiazol-2-yl)-4-methyl-5-(morpholin-4-yl)-3,6-dioxo-2,3,5,6-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl]-N-(3,5-dimethylphenyl)acetamide
Catalog ID
STK262473
SMILES Cc1cc(cc(c1)C)NC(=O)Cn1c2cc(=O)n(c(c2c(=O)n1c1nc2c(s1)cccc2)C)N1CCOCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H28N6O4S MW 544.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O4S/c1-17-12-18(2)14-20(13-17)29-24(35)16-32-22-15-25(36)33(31-8-10-38-11-9-31)19(3)26(22)27(37)34(32)28-30-21-6-4-5-7-23(21)39-28/h4-7,12-15H,8-11,16H2,1-3H3,(H,29,35)InChIKey
KYZJNPBWJDMFOV-UHFFFAOYSA-NSynonyms
2(2(13benzothiazol2yl)4methyl5(morpholin4yl)36dioxo2356tetrahydro1Hpyrazolo(43c)pyridin1yl)N(35dimethylphenyl)acetamide
2(2(13benzothiazol2yl)4methyl5morpholin4yl36dioxopyrazolo(43c)pyridin1yl)N(35dimethylphenyl)acetamide
2(2BENZOTHIAZOL2YL4METHYL5MORPHOLIN4YL36DIOXO(5HYDRO3PYRAZOLINO(43C)PYRIDINYL))N(35DIMETHYLPHENYL)ACETAMIDE
CC1=CC(=CC(=C1)NC(=O)CN2C3=CC(=O)N(C(=C3C(=O)N2C4=NC5=CC=CC=C5S4)C)N6CCOCC6)C
InChI=1SC28H28N6O4Sc1171218(2)1420(1317)2924(35)1632221525(36)33(318103811931)19(3)26(22)27(37)34(32)283021645723(21)3928h471215H81116H213H3(H2935)
MFCD07774023
ZINC000098042807
ZINC98042807
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