Vitas-M small molecule compound
2-{[8,8-dimethyl-11-(morpholin-4-yl)-7,10-dihydro-8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Catalog ID
STK572307
SMILES COc1cccc(c1)NC(=O)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1
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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 C28H29N7O4S2 MW 591.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N7O4S2/c1-28(2)12-18-19(13-39-28)24(34-7-9-38-10-8-34)31-26-21(18)22-23(41-26)25-32-33-27(35(25)15-29-22)40-14-20(36)30-16-5-4-6-17(11-16)37-3/h4-6,11,15H,7-10,12-14H2,1-3H3,(H,30,36)InChIKey
BUXYTIOMHDYPRD-UHFFFAOYSA-NSynonyms
2((88dimethyl11(morpholin4yl)710dihydro8Hpyrano(4345)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)N(3methoxyphenyl)acetamide
2((88dimethyl11morpholino810dihydro7Hpyrano(4345)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)thio)N(3methoxyphenyl)acetamide
CC1(CC2=C3C4=C(C5=NN=C(N5C=N4)SCC(=O)NC6=CC(=CC=C6)OC)SC3=NC(=C2CO1)N7CCOCC7)C
InChI=1SC28H29N7O4S2c128(2)121819(133928)24(34793810834)312621(18)2223(4126)25323327(35(25)152922)401420(36)301654617(1116)373h461115H7101214H213H3(H3036)
MFCD03676016
ZINC000102568679
ZINC102568679
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