Vitas-M small molecule compound
2-{2-(1,3-benzothiazol-2-yl)-4-methyl-5-[3-(morpholin-4-yl)propyl]-3,6-dioxo-2,3,5,6-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK262472
SMILES Fc1ccc(cc1)NC(=O)Cn1c2cc(=O)n(c(c2c(=O)n1c1nc2c(s1)cccc2)C)CCCN1CCOCC1
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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 C29H29FN6O4S MW 576.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29FN6O4S/c1-19-27-23(17-26(38)34(19)12-4-11-33-13-15-40-16-14-33)35(18-25(37)31-21-9-7-20(30)8-10-21)36(28(27)39)29-32-22-5-2-3-6-24(22)41-29/h2-3,5-10,17H,4,11-16,18H2,1H3,(H,31,37)InChIKey
XNKBHHQORWMDKA-UHFFFAOYSA-NSynonyms
2(2(13benzothiazol2yl)4methyl5(3(morpholin4yl)propyl)36dioxo2356tetrahydro1Hpyrazolo(43c)pyridin1yl)N(4fluorophenyl)acetamide
2(2(13benzothiazol2yl)4methyl5(3morpholin4ylpropyl)36dioxopyrazolo(43c)pyridin1yl)N(4fluorophenyl)acetamide
2(2BENZOTHIAZOL2YL4METHYL5(3MORPHOLIN4YLPROPYL)36DIOXO(5HYDRO3PYRAZOLINO(43C)PYRIDINYL))N(4FLUOROPHENYL)ACETAMIDE
CC1=C2C(=CC(=O)N1CCCN3CCOCC3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC(=O)NC6=CC=C(C=C6)F
InChI=1SC29H29FN6O4Sc1192723(1726(38)34(19)1241133131540161433)35(1825(37)31219720(30)81021)36(28(27)39)293222523624(22)4129h2351017H4111618H21H3(H3137)
MFCD07774021
ZINC000098042806
ZINC98042806
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