Vitas-M small molecule compound
propan-2-yl 2-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK466090
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1ccc(cc1[N+](=O)[O-])Cl)CC
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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 C21H24ClN3O6S MW 481.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O6S/c1-6-24(7-2)20(27)17-12(5)16(21(28)31-11(3)4)19(32-17)23-18(26)14-9-8-13(22)10-15(14)25(29)30/h8-11H,6-7H2,1-5H3,(H,23,26)InChIKey
FVEPLVWGCDMEHN-UHFFFAOYSA-NSynonyms
CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1ccc(cc1(N+)(=O)(O))Cl)CC
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C=C(C=C2)Cl)(N+)(=O)(O))C(=O)OC(C)C)C
InChI=1SC21H24ClN3O6Sc1624(72)20(27)1712(5)16(21(28)3111(3)4)19(3217)2318(26)149813(22)1015(14)25(29)30h811H67H215H3(H2326)
METHYLETHYL5(NNDIETHYLCARBAMOYL)2((4CHLORO2NITROPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03384081
propan2yl2(((4chloro2nitrophenyl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
PROPAN2YL2((4CHLORO2NITROBENZOYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000020608580
ZINC20608580
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