Vitas-M small molecule compound

N-(2,4-dimethoxyphenyl)-2-{[(3-methylpiperidin-1-yl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Catalog ID
STK117428
SMILES COc1cc(OC)ccc1NC(=O)c1c(NC(=O)CN2CCCC(C2)C)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 C24H31N3O4S MW 457.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O4S/c1-15-6-5-11-27(13-15)14-21(28)26-24-22(17-7-4-8-20(17)32-24)23(29)25-18-10-9-16(30-2)12-19(18)31-3/h9-10,12,15H,4-8,11,13-14H2,1-3H3,(H,25,29)(H,26,28)
InChIKey
TXVAIBWXXBXKQR-UHFFFAOYSA-N
Synonyms

CC1CCCN(C1)CC(=O)NC2=C(C3=C(S2)CCC3)C(=O)NC4=C(C=C(C=C4)OC)OC
InChI=1SC24H31N3O4Sc115651127(1315)1421(28)262422(1774820(17)3224)23(29)251810916(302)1219(18)313h9101215H48111314H213H3(H2529)(H2628)
MFCD03103845
N(24DIMETHOXYPHENYL)2(((3METHYLPIPERIDIN1YL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXAMIDE
N(24DIMETHOXYPHENYL)2((2(3METHYLPIPERIDIN1YL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXAMIDE
N(3(N(24DIMETHOXYPHENYL)CARBAMOYL)(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))2(3METHYLPIPERIDYL)ACETAMIDE
ZINC000000729065
ZINC000012629320

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Available files

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