Vitas-M small molecule compound

dimethyl 2-[(butoxycarbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Catalog ID
STL331304
SMILES CCCCOC(=O)Nc1sc2c(c1C(=O)OC)C(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 C16H21NO6S MW 355.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO6S/c1-4-5-8-23-16(20)17-13-12(15(19)22-3)11-9(14(18)21-2)6-7-10(11)24-13/h9H,4-8H2,1-3H3,(H,17,20)
InChIKey
RTQFJBFZWJFUDV-UHFFFAOYSA-N
Synonyms
370852-42-9
370852429
CCCCOC(=O)NC1=C(C2=C(S1)CCC2C(=O)OC)C(=O)OC
dimethyl2((butoxycarbonyl)amino)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
DIMETHYL2(BUTOXYCARBONYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
InChI=1SC16H21NO6Sc14582316(20)171312(15(19)223)119(14(18)212)6710(11)2413h9H48H213H3(H1720)
METHYL2(BUTOXYCARBONYLAMINO)3(METHOXYCARBONYL)456TRIHYDROCYCLOPENTA(32B)THIOPHENE4CARBOXYLATE
MFCD02358139
ZINC000004040512
ZINC000004040515

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Available files

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