Vitas-M small molecule compound

methyl 2-{[(2-methoxydibenzo[b,d]furan-3-yl)carbamothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK455440
SMILES COc1cc2c(cc1NC(=S)Nc1sc3c(c1C(=O)OC)CCC3)oc1c2cccc1

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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 C23H20N2O4S2 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O4S2/c1-27-18-10-14-12-6-3-4-8-16(12)29-17(14)11-15(18)24-23(30)25-21-20(22(26)28-2)13-7-5-9-19(13)31-21/h3-4,6,8,10-11H,5,7,9H2,1-2H3,(H2,24,25,30)
InChIKey
UDSBTPHMLGYNMM-UHFFFAOYSA-N
Synonyms

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=S)NC4=C(C5=C(S4)CCC5)C(=O)OC
InChI=1SC23H20N2O4S2c12718101412634816(12)2917(14)1115(18)2423(30)252120(22(26)282)1375919(13)3121h34681011H579H212H3(H2242530)
METHYL2((((2METHOXYBENZO(34B)BENZO(D)FURAN3YL)AMINO)THIOXOMETHYL)AMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
methyl2(((2methoxydibenzo(bd)furan3yl)carbamothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((2METHOXYDIBENZOFURAN3YL)CARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD04227404
ZINC000002858225
ZINC02858225
ZINC2858225

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Available files

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