Vitas-M small molecule compound
ethyl 2-(1,3-benzoxazol-2-ylamino)-4-{[(4-methylphenyl)sulfanyl]methyl}pyrimidine-5-carboxylate
Catalog ID
STK167084
SMILES CCOC(=O)c1cnc(nc1CSc1ccc(cc1)C)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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-3-28-20(27)16-12-23-21(26-22-25-17-6-4-5-7-19(17)29-22)24-18(16)13-30-15-10-8-14(2)9-11-15/h4-12H,3,13H2,1-2H3,(H,23,24,25,26)InChIKey
NOBPMJYBLLZVCU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1CSC2=CC=C(C=C2)C)NC3=NC4=CC=CC=C4O3
ETHYL2(13BENZOXAZOL2YLAMINO)4(((4METHYLPHENYL)SULFANYL)METHYL)PYRIMIDINE5CARBOXYLATE
ETHYL2(13BENZOXAZOL2YLAMINO)4((4METHYLPHENYL)SULFANYLMETHYL)PYRIMIDINE5CARBOXYLATE
InChI=1SC22H20N4O3Sc132820(27)16122321(26222517645719(17)2922)2418(16)13301510814(2)91115h412H313H212H3(H23242526)
MFCD04189100
ZINC000001425605
ZINC01425605
ZINC1425605
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