Vitas-M small molecule compound

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}-N-(2-methylphenyl)acetamide

Catalog ID
STL448072
SMILES CSc1nc(SCC(=O)Nc2ccccc2C)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 C28H31N5O3S3 MW 581.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O3S3/c1-16-7-5-6-8-19(16)29-20(34)15-38-26-23-22(30-27(32-26)37-4)21-17-13-28(2,3)36-14-18(17)24(31-25(21)39-23)33-9-11-35-12-10-33/h5-8H,9-15H2,1-4H3,(H,29,34)
InChIKey
BKBBHGFIAYVCFT-UHFFFAOYSA-N
Synonyms

2((22dimethyl10(methylsulfanyl)5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)N(2methylphenyl)acetamide
CC1=CC=CC=C1NC(=O)CSC2=NC(=NC3=C2SC4=NC(=C5COC(CC5=C34)(C)C)N6CCOCC6)SC
InChI=1SC28H31N5O3S3c116756819(16)2920(34)1538262322(3027(3226)374)21171328(23)361418(17)24(3125(21)3923)3391135121033h58H915H214H3(H2934)
MFCD07773592
ZINC000008767889
ZINC8767889

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Available files

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