Vitas-M small molecule compound

methyl 2-{[(2-methyl-5-oxopyrazolidin-3-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STL020593
SMILES COC(=O)c1c(NC(=O)C2CC(=O)NN2C)sc2c1CCC2

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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 C14H17N3O4S MW 323.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O4S/c1-17-8(6-10(18)16-17)12(19)15-13-11(14(20)21-2)7-4-3-5-9(7)22-13/h8H,3-6H2,1-2H3,(H,15,19)(H,16,18)
InChIKey
KJVWLUXSDCUYHZ-UHFFFAOYSA-N
Synonyms
956203-95-5
956203955
CN1C(CC(=O)N1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC
InChI=1SC14H17N3O4Sc1178(610(18)1617)12(19)151311(14(20)212)74359(7)2213h8H36H212H3(H1519)(H1618)
METHYL2((((3R)2METHYL5OXOPYRAZOLIDIN3YL)CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
methyl2(((2methyl5oxopyrazolidin3yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((2METHYL5OXOPYRAZOLIDIN3YL)CARBONYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
METHYL2((2METHYL5OXOPYRAZOLIDINE3CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2(2METHYL5OXOPYRAZOLIDINE3CARBOXAMIDO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD06420383
ZINC000002890027
ZINC000002890028

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Available files

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