Vitas-M small molecule compound
2-{2-[(2-chloro-4,5-difluorobenzyl)sulfanyl]-5-methyl-1,3-benzoxazol-7-yl}-2H-benzotriazole
Catalog ID
STK737365
SMILES Cc1cc2nc(oc2c(c1)n1nc2c(n1)cccc2)SCc1cc(F)c(cc1Cl)F
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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 C21H13ClF2N4OS MW 442.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClF2N4OS/c1-11-6-18-20(19(7-11)28-26-16-4-2-3-5-17(16)27-28)29-21(25-18)30-10-12-8-14(23)15(24)9-13(12)22/h2-9H,10H2,1H3InChIKey
SSMOYOQSKHLVAO-UHFFFAOYSA-NSynonyms
2(2((2chloro45difluorobenzyl)sulfanyl)5methyl13benzoxazol7yl)2Hbenzotriazole
7(BENZOTRIAZOL2YL)2((2CHLORO45DIFLUOROPHENYL)METHYLSULFANYL)5METHYL13BENZOXAZOLE
CC1=CC2=C(C(=C1)N3N=C4C=CC=CC4=N3)OC(=N2)SCC5=CC(=C(C=C5Cl)F)F
InChI=1SC21H13ClF2N4OSc11161820(19(711)282616423517(16)2728)2921(2518)301012814(23)15(24)913(12)22h29H10H21H3
MFCD06017832
ZINC000012446756
ZINC12446756
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