Vitas-M small molecule compound
N-[1-methyl-2-(piperidin-1-ylmethyl)-1H-benzimidazol-5-yl]-2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)acetamide
Catalog ID
STL408773
SMILES O=C(CN1c2cccnc2Sc2c(C1=O)cccc2)Nc1ccc2c(c1)nc(n2C)CN1CCCCC1
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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 C28H28N6O2S MW 512.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O2S/c1-32-22-12-11-19(16-21(22)31-25(32)17-33-14-5-2-6-15-33)30-26(35)18-34-23-9-7-13-29-27(23)37-24-10-4-3-8-20(24)28(34)36/h3-4,7-13,16H,2,5-6,14-15,17-18H2,1H3,(H,30,35)InChIKey
VJQKMLHMSPVINZ-UHFFFAOYSA-NSynonyms
1574353-63-11574353631
CN1C2=C(C=C(C=C2)NC(=O)CN3C4=C(N=CC=C4)SC5=CC=CC=C5C3=O)N=C1CN6CCCCC6
InChI=1SC28H28N6O2Sc13222121119(1621(22)3125(32)1733145261533)3026(35)18342397132927(23)37241043820(24)28(34)36h3471316H25614151718H21H3(H3035)
MFCD28057856
N(1methyl2(piperidin1ylmethyl)1Hbenzimidazol5yl)2(6oxopyrido(23b)(14)benzothiazepin5(6H)yl)acetamide
N(1methyl2(piperidin1ylmethyl)1Hbenzo(d)imidazol5yl)2(6oxobenzo(f)pyrido(23b)(14)thiazepin5(6H)yl)acetamide
N(1methyl2(piperidin1ylmethyl)benzimidazol5yl)2(6oxopyrido(23b)(14)benzothiazepin5yl)acetamide
ZINC000096223044
ZINC96223044
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