Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-10-methoxy-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-6(7H)-one
Catalog ID
STK578717
SMILES COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1c(F)cccc1Cl
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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 C21H17ClFN3O2S MW 429.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClFN3O2S/c1-28-12-6-7-17-13(10-12)18-19(20(27)25-8-3-9-29-21(25)24-18)26(17)11-14-15(22)4-2-5-16(14)23/h2,4-7,10H,3,8-9,11H2,1H3InChIKey
JHOVMYMHFBAGKL-UHFFFAOYSA-NSynonyms
879586-13-77(2chloro6fluorobenzyl)10methoxy34dihydro2H(13)thiazino(3212)pyrimido(54b)indol6(7H)one
879586137
COC1=CC2=C(C=C1)N(C3=C2N=C4N(C3=O)CCCS4)CC5=C(C=CC=C5Cl)F
InChI=1SC21H17ClFN3O2Sc12812671713(1012)1819(20(27)258392921(25)2418)26(17)111415(22)42516(14)23h24710H38911H21H3
MFCD07641500
ZINC000008994128
ZINC08994128
ZINC8994128
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