Vitas-M small molecule compound

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

Catalog ID
STK401692
SMILES COC(=O)c1c(NC(=O)Cc2ccc(c(c2)OC)OC)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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-23-13-8-7-11(9-14(13)24-2)10-16(21)20-18-17(19(22)25-3)12-5-4-6-15(12)26-18/h7-9H,4-6,10H2,1-3H3,(H,20,21)
InChIKey
MRFNFIPQIPBANM-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)CC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)OC
InChI=1SC19H21NO5Sc123138711(914(13)242)1016(21)201817(19(22)253)1254615(12)2618h79H4610H213H3(H2021)
methyl2(((34dimethoxyphenyl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((2(34DIMETHOXYPHENYL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2(2(34DIMETHOXYPHENYL)ACETYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
MFCD03070811
ZINC000000673127
ZINC00673127
ZINC673127

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Available files

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