Vitas-M small molecule compound
2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]cyclohexanecarboxylic acid
Catalog ID
STK471981
SMILES N#Cc1c(NC(=O)C2CCCCC2C(=O)O)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 C16H18N2O3S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S/c17-8-12-9-6-3-7-13(9)22-15(12)18-14(19)10-4-1-2-5-11(10)16(20)21/h10-11H,1-7H2,(H,18,19)(H,20,21)InChIKey
NJMKBXYBPXZXPL-UHFFFAOYSA-NSynonyms
2((3cyano56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)cyclohexane1carboxylicacid
2((3cyano56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2(N(3CYANO456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
C1CCC(C(C1)C(=O)NC2=C(C3=C(S2)CCC3)C#N)C(=O)O
InChI=1SC16H18N2O3Sc17812963713(9)2215(12)1814(19)10412511(10)16(20)21h1011H17H2(H1819)(H2021)
MFCD02254171
ZINC000005725586
ZINC000005725600
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