Vitas-M small molecule compound
methyl 4-methyl-5-[(3-nitrophenyl)carbamoyl]-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STL170204
SMILES COC(=O)c1c(sc(c1C)C(=O)Nc1cccc(c1)[N+](=O)[O-])NC(=O)c1ccc(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 C21H16N4O8S MW 484.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O8S/c1-11-16(21(28)33-2)20(23-18(26)12-6-8-14(9-7-12)24(29)30)34-17(11)19(27)22-13-4-3-5-15(10-13)25(31)32/h3-10H,1-2H3,(H,22,27)(H,23,26)InChIKey
NGWSBLQQPUXTNV-UHFFFAOYSA-NSynonyms
362497-72-1362497721
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)NC3=CC(=CC=C3)(N+)(=O)(O)
COC(=O)c1c(sc(c1C)C(=O)Nc1cccc(c1)(N+)(=O)(O))NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H16N4O8Sc11116(21(28)332)20(2318(26)126814(9712)24(29)30)3417(11)19(27)221343515(1013)25(31)32h310H12H3(H2227)(H2326)
METHYL4METHYL2((4NITROBENZOYL)AMINO)5((3NITROPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
methyl4methyl5((3nitrophenyl)carbamoyl)2(((4nitrophenyl)carbonyl)amino)thiophene3carboxylate
METHYL4METHYL5(N(3NITROPHENYL)CARBAMOYL)2((4NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
METHYL5((3NITROANILINO)CARBONYL)2((4NITROBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
MFCD01193761
ZINC000002100634
ZINC02100634
ZINC2100634
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.