Vitas-M small molecule compound
N-ethyl-1-[6-(2-{[3-(methylsulfanyl)phenyl]amino}-2-oxoethyl)-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl]piperidine-3-carboxamide
Catalog ID
STL093053
SMILES CCNC(=O)C1CCCN(C1)c1nc2c(s1)c(=O)n(cn2)CC(=O)Nc1cccc(c1)SC
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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 C22H26N6O3S2 MW 486.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N6O3S2/c1-3-23-20(30)14-6-5-9-27(11-14)22-26-19-18(33-22)21(31)28(13-24-19)12-17(29)25-15-7-4-8-16(10-15)32-2/h4,7-8,10,13-14H,3,5-6,9,11-12H2,1-2H3,(H,23,30)(H,25,29)InChIKey
RECIQZAQKGJNMD-UHFFFAOYSA-NSynonyms
CCNC(=O)C1CCCN(C1)C2=NC3=C(S2)C(=O)N(C=N3)CC(=O)NC4=CC(=CC=C4)SC
InChI=1SC22H26N6O3S2c132320(30)1465927(1114)22261918(3322)21(31)28(132419)1217(29)251574816(1015)322h478101314H35691112H212H3(H2330)(H2529)
MFCD18787197
Nethyl1(6(2((3(methylsulfanyl)phenyl)amino)2oxoethyl)7oxo67dihydro(13)thiazolo(45d)pyrimidin2yl)piperidine3carboxamide
Nethyl1(6(2(3methylsulfanylanilino)2oxoethyl)7oxo(13)thiazolo(45d)pyrimidin2yl)piperidine3carboxamide
ZINC000067226307
ZINC000067226309
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