Vitas-M small molecule compound
N-(2,4-dichlorophenyl)-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}acetamide
Catalog ID
STK553405
SMILES O=C(Nc1ccc(cc1Cl)Cl)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 C27H25Cl2N7O3S2 MW 630.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25Cl2N7O3S2/c1-27(2)10-15-16(11-39-27)23(35-5-7-38-8-6-35)32-25-20(15)21-22(41-25)24-33-34-26(36(24)13-30-21)40-12-19(37)31-18-4-3-14(28)9-17(18)29/h3-4,9,13H,5-8,10-12H2,1-2H3,(H,31,37)InChIKey
ITRLGWSFOPQHEK-UHFFFAOYSA-NSynonyms
CC1(CC2=C3C4=C(C5=NN=C(N5C=N4)SCC(=O)NC6=C(C=C(C=C6)Cl)Cl)SC3=NC(=C2CO1)N7CCOCC7)C
InChI=1SC27H25Cl2N7O3S2c127(2)101516(113927)23(3557388635)322520(15)2122(4125)24333426(36(24)133021)401219(37)31184314(28)917(18)29h34913H581012H212H3(H3137)
MFCD03677321
N(24dichlorophenyl)2((88dimethyl11(morpholin4yl)710dihydro8Hpyrano(4345)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
N(24dichlorophenyl)2((88dimethyl11morpholino810dihydro7Hpyrano(4345)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000097999841
ZINC97999841
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