Vitas-M small molecule compound
1-(4-chlorophenyl)-2-{[2,2-dimethyl-10-(methylsulfanyl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}ethanone
Catalog ID
STL448079
SMILES CSc1nc(SCC(=O)c2ccc(cc2)Cl)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)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 C27H27ClN4O3S3 MW 587.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4O3S3/c1-27(2)12-17-18(13-35-27)23(32-8-10-34-11-9-32)30-24-20(17)21-22(38-24)25(31-26(29-21)36-3)37-14-19(33)15-4-6-16(28)7-5-15/h4-7H,8-14H2,1-3H3InChIKey
DNQBFOALTHDVCC-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)2((22dimethyl10(methylsulfanyl)5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)ethanone
CC1(CC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)C5=CC=C(C=C5)Cl)SC3=NC(=C2CO1)N6CCOCC6)C
InChI=1SC27H27ClN4O3S3c127(2)121718(133527)23(328103411932)302420(17)2122(3824)25(3126(2921)363)371419(33)154616(28)7515h47H814H213H3
MFCD07773598
ZINC000101381220
ZINC101381220
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