Vitas-M small molecule compound

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

Catalog ID
STK207253
SMILES Brc1ccc(cc1)NC(=O)Cn1c2cc(=O)n(c(c2c(=O)n1c1nc2c(s1)cccc2)C)CCc1c[nH]c2c1cccc2

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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 C32H25BrN6O3S MW 653.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25BrN6O3S/c1-19-30-26(16-29(41)37(19)15-14-20-17-34-24-7-3-2-6-23(20)24)38(18-28(40)35-22-12-10-21(33)11-13-22)39(31(30)42)32-36-25-8-4-5-9-27(25)43-32/h2-13,16-17,34H,14-15,18H2,1H3,(H,35,40)
InChIKey
KNUOKPFVOGMONY-UHFFFAOYSA-N
Synonyms

2(2(13benzothiazol2yl)5(2(1Hindol3yl)ethyl)4methyl36dioxo2356tetrahydro1Hpyrazolo(43c)pyridin1yl)N(4bromophenyl)acetamide
2(2(13BENZOTHIAZOL2YL)5(2(1HINDOL3YL)ETHYL)4METHYL36DIOXOPYRAZOLO(43C)PYRIDIN1YL)N(4BROMOPHENYL)ACETAMIDE
2(2BENZOTHIAZOL2YL5(2INDOL3YLETHYL)4METHYL36DIOXO(5HYDRO3PYRAZOLINO(43C)PYRIDINYL))N(4BROMOPHENYL)ACETAMIDE
Brc1ccc(cc1)NC(=O)Cn1c2cc(=O)n(c(c2c(=O)n1c1nc2c(s1)cccc2)C)CCc1c(nH)c2c1cccc2
CC1=C2C(=CC(=O)N1CCC3=CNC4=CC=CC=C43)N(N(C2=O)C5=NC6=CC=CC=C6S5)CC(=O)NC7=CC=C(C=C7)Br
InChI=1SC32H25BrN6O3Sc1193026(1629(41)37(19)151420173424732623(20)24)38(1828(40)3522121021(33)111322)39(31(30)42)323625845927(25)4332h213161734H141518H21H3(H3540)
MFCD06242261
ZINC000097949161
ZINC97949161

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Available files

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