Vitas-M small molecule compound
methyl 4-(3,4-dimethylphenyl)-2-{[(4-nitrophenyl)acetyl]amino}thiophene-3-carboxylate
Catalog ID
STK316801
SMILES COC(=O)c1c(scc1c1ccc(c(c1)C)C)NC(=O)Cc1ccc(cc1)[N+](=O)[O-]
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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 C22H20N2O5S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S/c1-13-4-7-16(10-14(13)2)18-12-30-21(20(18)22(26)29-3)23-19(25)11-15-5-8-17(9-6-15)24(27)28/h4-10,12H,11H2,1-3H3,(H,23,25)InChIKey
KCTHXCXCJGCEHY-UHFFFAOYSA-NSynonyms
445013-55-8445013558
CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CC3=CC=C(C=C3)(N+)(=O)(O))C
COC(=O)c1c(scc1c1ccc(c(c1)C)C)NC(=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H20N2O5Sc1134716(1014(13)2)18123021(20(18)22(26)293)2319(25)11155817(9615)24(27)28h41012H11H213H3(H2325)
methyl4(34dimethylphenyl)2(((4nitrophenyl)acetyl)amino)thiophene3carboxylate
METHYL4(34DIMETHYLPHENYL)2((2(4NITROPHENYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD02607545
ZINC000000681644
ZINC00681644
ZINC681644
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