Vitas-M small molecule compound

methyl 2-{[(5-chloro-2-nitrophenyl)carbonyl]amino}-4-(4-chlorophenyl)thiophene-3-carboxylate

Catalog ID
STK433941
SMILES COC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)c1cc(Cl)ccc1[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 C19H12Cl2N2O5S MW 451.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12Cl2N2O5S/c1-28-19(25)16-14(10-2-4-11(20)5-3-10)9-29-18(16)22-17(24)13-8-12(21)6-7-15(13)23(26)27/h2-9H,1H3,(H,22,24)
InChIKey
IVOFLBMXWCVMAA-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C3=C(C=CC(=C3)Cl)(N+)(=O)(O)
COC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)c1cc(Cl)ccc1(N+)(=O)(O)
InChI=1SC19H12Cl2N2O5Sc12819(25)1614(102411(20)5310)92918(16)2217(24)13812(21)6715(13)23(26)27h29H1H3(H2224)
methyl2(((5chloro2nitrophenyl)carbonyl)amino)4(4chlorophenyl)thiophene3carboxylate
METHYL2((5CHLORO2NITROBENZOYL)AMINO)4(4CHLOROPHENYL)3THIOPHENECARBOXYLATE
METHYL2((5CHLORO2NITROBENZOYL)AMINO)4(4CHLOROPHENYL)THIOPHENE3CARBOXYLATE
METHYL2((5CHLORO2NITROPHENYL)CARBONYLAMINO)4(4CHLOROPHENYL)THIOPHENE3CARBOXYLATE
MFCD03391851
ZINC000002767935
ZINC02767935
ZINC2767935

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.