Vitas-M small molecule compound
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2-chloro-4-nitrophenoxy)-N-(tetrahydrofuran-2-ylmethyl)propanamide
Catalog ID
STL179023
SMILES O=C(N(c1nc(c(s1)C(=O)C)C)CC1CCCO1)C(Oc1ccc(cc1Cl)[N+](=O)[O-])C
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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 C20H22ClN3O6S MW 467.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O6S/c1-11-18(12(2)25)31-20(22-11)23(10-15-5-4-8-29-15)19(26)13(3)30-17-7-6-14(24(27)28)9-16(17)21/h6-7,9,13,15H,4-5,8,10H2,1-3H3InChIKey
PLGUJPSKHUPSOB-UHFFFAOYSA-NSynonyms
CC1=C(SC(=N1)N(CC2CCCO2)C(=O)C(C)OC3=C(C=C(C=C3)(N+)(=O)(O))Cl)C(=O)C
InChI=1SC20H22ClN3O6Sc11118(12(2)25)3120(2211)23(10155482915)19(26)13(3)30177614(24(27)28)916(17)21h6791315H45810H213H3
MFCD08555404
N(5acetyl4methyl13thiazol2yl)2(2chloro4nitrophenoxy)N(oxolan2ylmethyl)propanamide
N(5acetyl4methyl13thiazol2yl)2(2chloro4nitrophenoxy)N(tetrahydrofuran2ylmethyl)propanamide
O=C(N(c1nc(c(s1)C(=O)C)C)CC1CCCO1)C(Oc1ccc(cc1Cl)(N+)(=O)(O))C
ZINC000036614030
ZINC000036614033
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