Vitas-M small molecule compound
ethyl 4-amino-2-[(2-{[4-iodo-2-(propan-2-yl)phenyl]amino}-2-oxoethyl)sulfanyl]pyrimidine-5-carboxylate
Catalog ID
STL415711
SMILES CCOC(=O)c1cnc(nc1N)SCC(=O)Nc1ccc(cc1C(C)C)I
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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 C18H21IN4O3S MW 500.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21IN4O3S/c1-4-26-17(25)13-8-21-18(23-16(13)20)27-9-15(24)22-14-6-5-11(19)7-12(14)10(2)3/h5-8,10H,4,9H2,1-3H3,(H,22,24)(H2,20,21,23)InChIKey
WIOYWCCPUJBHCG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=C(C=C(C=C2)I)C(C)C
ethyl4amino2((2((4iodo2(propan2yl)phenyl)amino)2oxoethyl)sulfanyl)pyrimidine5carboxylate
ETHYL4AMINO2(2(4IODO2PROPAN2YLANILINO)2OXOETHYL)SULFANYLPYRIMIDINE5CARBOXYLATE
InChI=1SC18H21IN4O3Sc142617(25)1382118(2316(13)20)27915(24)22146511(19)712(14)10(2)3h5810H49H213H3(H2224)(H2202123)
MFCD07178711
ZINC000016474333
ZINC16474333
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