Vitas-M small molecule compound
ethyl 2-(1,3-benzoxazol-2-ylamino)-4-{[(4-chlorophenyl)sulfanyl]methyl}pyrimidine-5-carboxylate
Catalog ID
STL070949
SMILES CCOC(=O)c1cnc(nc1CSc1ccc(cc1)Cl)Nc1nc2c(o1)cccc2
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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 C21H17ClN4O3S MW 440.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O3S/c1-2-28-19(27)15-11-23-20(26-21-25-16-5-3-4-6-18(16)29-21)24-17(15)12-30-14-9-7-13(22)8-10-14/h3-11H,2,12H2,1H3,(H,23,24,25,26)InChIKey
YQTLVEIYJUVYSS-UHFFFAOYSA-NSynonyms
669718-81-4669718814
CCOC(=O)C1=CN=C(N=C1CSC2=CC=C(C=C2)Cl)NC3=NC4=CC=CC=C4O3
ethyl2(13benzoxazol2ylamino)4(((4chlorophenyl)sulfanyl)methyl)pyrimidine5carboxylate
ETHYL2(13BENZOXAZOL2YLAMINO)4((4CHLOROPHENYL)SULFANYLMETHYL)PYRIMIDINE5CARBOXYLATE
ethyl2(benzo(d)oxazol2ylamino)4(((4chlorophenyl)thio)methyl)pyrimidine5carboxylate
InChI=1SC21H17ClN4O3Sc122819(27)15112320(26212516534618(16)2921)2417(15)1230149713(22)81014h311H212H21H3(H23242526)
MFCD04161008
ZINC000009111305
ZINC09111305
ZINC9111305
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