Vitas-M small molecule compound
6-(azepan-1-ylsulfonyl)-3-[2-(4-chlorophenyl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one
Catalog ID
STK983521
SMILES Clc1ccc(cc1)C(=O)Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCCC1
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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 C21H21ClN2O5S MW 448.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O5S/c22-16-7-5-15(6-8-16)19(25)14-24-18-10-9-17(13-20(18)29-21(24)26)30(27,28)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12,14H2InChIKey
NDFCKXWDISFBPY-UHFFFAOYSA-NSynonyms
6(azepan1ylsulfonyl)3(2(4chlorophenyl)2oxoethyl)13benzoxazol2(3H)one
6(azepan1ylsulfonyl)3(2(4chlorophenyl)2oxoethyl)13benzoxazol2one
C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)C4=CC=C(C=C4)Cl
InChI=1SC21H21ClN2O5Sc22167515(6816)19(25)14241810917(1320(18)2921(24)26)30(2728)231131241223h51013H14111214H2
MFCD08847680
ZINC000011689600
ZINC11689600
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