Vitas-M small molecule compound
methyl 5-(diethylcarbamoyl)-4-methyl-2-{[(4-methyl-3-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK433799
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)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 C20H23N3O6S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O6S/c1-6-22(7-2)19(25)16-12(4)15(20(26)29-5)18(30-16)21-17(24)13-9-8-11(3)14(10-13)23(27)28/h8-10H,6-7H2,1-5H3,(H,21,24)InChIKey
OVEMWIXDJZAYDX-UHFFFAOYSA-NSynonyms
CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C)CC
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)C)(N+)(=O)(O))C(=O)OC)C
InChI=1SC20H23N3O6Sc1622(72)19(25)1612(4)15(20(26)295)18(3016)2117(24)139811(3)14(1013)23(27)28h810H67H215H3(H2124)
METHYL5((DIETHYLAMINO)CARBONYL)2((3NITRO4METHYLBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
methyl5(diethylcarbamoyl)4methyl2(((4methyl3nitrophenyl)carbonyl)amino)thiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)4METHYL2((4METHYL3NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)4METHYL2((4METHYL3NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02231848
ZINC000000871960
ZINC00871960
ZINC871960
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.