Vitas-M small molecule compound

2-{2-(1,3-benzothiazol-2-yl)-4-methyl-5-[2-(morpholin-4-yl)ethyl]-3,6-dioxo-2,3,5,6-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl}-N-(4-methoxyphenyl)acetamide

Catalog ID
STK207252
SMILES COc1ccc(cc1)NC(=O)Cn1c2cc(=O)n(c(c2c(=O)n1c1nc2c(s1)cccc2)C)CCN1CCOCC1

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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 C29H30N6O5S MW 574.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N6O5S/c1-19-27-23(17-26(37)33(19)12-11-32-13-15-40-16-14-32)34(18-25(36)30-20-7-9-21(39-2)10-8-20)35(28(27)38)29-31-22-5-3-4-6-24(22)41-29/h3-10,17H,11-16,18H2,1-2H3,(H,30,36)
InChIKey
VGXQEHZDZWJOTM-UHFFFAOYSA-N
Synonyms

2(2(13benzothiazol2yl)4methyl5(2(morpholin4yl)ethyl)36dioxo2356tetrahydro1Hpyrazolo(43c)pyridin1yl)N(4methoxyphenyl)acetamide
2(2(13BENZOTHIAZOL2YL)4METHYL5(2MORPHOLIN4YLETHYL)36DIOXOPYRAZOLO(43C)PYRIDIN1YL)N(4METHOXYPHENYL)ACETAMIDE
2(2BENZOTHIAZOL2YL4METHYL5(2MORPHOLIN4YLETHYL)36DIOXO(5HYDRO3PYRAZOLINO(43C)PYRIDINYL))N(4METHOXYPHENYL)ACETAMIDE
CC1=C2C(=CC(=O)N1CCN3CCOCC3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC(=O)NC6=CC=C(C=C6)OC
InChI=1SC29H30N6O5Sc1192723(1726(37)33(19)121132131540161432)34(1825(36)30207921(392)10820)35(28(27)38)293122534624(22)4129h31017H111618H212H3(H3036)
MFCD06242260
ZINC000097948487
ZINC97948487

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Available files

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