Vitas-M small molecule compound

6-{[3-(cyclohexylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK471022
SMILES O=C(C1CC=CCC1C(=O)O)Nc1sc2c(c1C(=O)NC1CCCCC1)CCC2

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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 C22H28N2O4S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O4S/c25-19(14-9-4-5-10-15(14)22(27)28)24-21-18(16-11-6-12-17(16)29-21)20(26)23-13-7-2-1-3-8-13/h4-5,13-15H,1-3,6-12H2,(H,23,26)(H,24,25)(H,27,28)
InChIKey
CDAQZPATSIGLSB-UHFFFAOYSA-N
Synonyms

6((3(cyclohexylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6(N(3(NCYCLOHEXYLCARBAMOYL)456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
C1CCC(CC1)NC(=O)C2=C(SC3=C2CCC3)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC22H28N2O4Sc2519(149451015(14)22(27)28)242118(161161217(16)2921)20(26)23137213813h451315H13612H2(H2326)(H2425)(H2728)
MFCD06023304
ZINC000017090765
ZINC000017090768

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Available files

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