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-methylphenyl)acetamide
Catalog ID
STL482251
SMILES Cc1ccc(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 C30H32N6O4S MW 572.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N6O4S/c1-20-8-10-22(11-9-20)31-26(37)19-35-24-18-27(38)34(13-5-12-33-14-16-40-17-15-33)21(2)28(24)29(39)36(35)30-32-23-6-3-4-7-25(23)41-30/h3-4,6-11,18H,5,12-17,19H2,1-2H3,(H,31,37)InChIKey
MUKMIQMFBPWWBK-UHFFFAOYSA-NSynonyms
2(2(13benzothiazol2yl)4methyl5(3(morpholin4yl)propyl)36dioxo2356tetrahydro1Hpyrazolo(43c)pyridin1yl)N(4methylphenyl)acetamide
2(2(13benzothiazol2yl)4methyl5(3morpholin4ylpropyl)36dioxopyrazolo(43c)pyridin1yl)N(4methylphenyl)acetamide
2(2BENZOTHIAZOL2YL4METHYL5(3MORPHOLIN4YLPROPYL)36DIOXO(5HYDRO3PYRAZOLINO(43C)PYRIDINYL))N(4METHYLPHENYL)ACETAMIDE
CC1=CC=C(C=C1)NC(=O)CN2C3=CC(=O)N(C(=C3C(=O)N2C4=NC5=CC=CC=C5S4)C)CCCN6CCOCC6
InChI=1SC30H32N6O4Sc12081022(11920)3126(37)1935241827(38)34(1351233141640171533)21(2)28(24)29(39)36(35)303223634725(23)4130h3461118H5121719H212H3(H3137)
MFCD07626799
ZINC000100432321
ZINC100432321
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