Vitas-M small molecule compound

methyl 2-({[4-(acetylamino)phenyl]sulfonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate

Catalog ID
STK443839
SMILES COC(=O)c1c(sc2c1CCCCCC2)NS(=O)(=O)c1ccc(cc1)NC(=O)C

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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 C20H24N2O5S2 MW 436.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5S2/c1-13(23)21-14-9-11-15(12-10-14)29(25,26)22-19-18(20(24)27-2)16-7-5-3-4-6-8-17(16)28-19/h9-12,22H,3-8H2,1-2H3,(H,21,23)
InChIKey
YOWPXNUWVVVHSU-UHFFFAOYSA-N
Synonyms

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)OC
InChI=1SC20H24N2O5S2c113(23)211491115(121014)29(2526)221918(20(24)272)1675346817(16)2819h91222H38H212H3(H2123)
methyl2(((4(acetylamino)phenyl)sulfonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((4acetamidophenyl)sulfonylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD01835225
ZINC000000670445
ZINC00670445
ZINC670445

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Available files

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