Vitas-M small molecule compound

dimethyl 2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Catalog ID
STL330862
SMILES COC(=O)c1c(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])sc2c1C(CC2)C(=O)OC

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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 C18H15ClN2O7S MW 438.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O7S/c1-27-17(23)9-4-6-12-13(9)14(18(24)28-2)16(29-12)20-15(22)10-7-8(21(25)26)3-5-11(10)19/h3,5,7,9H,4,6H2,1-2H3,(H,20,22)
InChIKey
RZGTVJJGISNFDP-UHFFFAOYSA-N
Synonyms
302802-88-6
302802886
COC(=O)c1c(NC(=O)c2cc(ccc2Cl)(N+)(=O)(O))sc2c1C(CC2)C(=O)OC
COC(=O)C1CCC2=C1C(=C(S2)NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)C(=O)OC
DIMETHYL(4R)2((2CHLORO5NITROBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
DIMETHYL(4S)2((2CHLORO5NITROBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
dimethyl2(((2chloro5nitrophenyl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
DIMETHYL2((2CHLORO5NITROBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
dimethyl2(2chloro5nitrobenzamido)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
InChI=1SC18H15ClN2O7Sc12717(23)9461213(9)14(18(24)282)16(2912)2015(22)1078(21(25)26)3511(10)19h3579H46H212H3(H2022)
METHYL2((2CHLORO5NITROPHENYL)CARBONYLAMINO)3(METHOXYCARBONYL)456TRIHYDROCYCLOPENTA(32B)THIOPHENE4CARBOXYLATE
MFCD02331738
ZINC000001744162
ZINC000001744163

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Available files

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