Vitas-M small molecule compound
6-{[3-(cyclopentylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK470899
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1sc2c(c1C(=O)NC1CCCC1)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 C23H30N2O4S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O4S/c1-12-10-16(17(23(28)29)11-13(12)2)20(26)25-22-19(15-8-5-9-18(15)30-22)21(27)24-14-6-3-4-7-14/h14,16-17H,3-11H2,1-2H3,(H,24,27)(H,25,26)(H,28,29)InChIKey
BCBBDAMMUJMBBE-UHFFFAOYSA-NSynonyms
6((3(cyclopentylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(3(NCYCLOPENTYLCARBAMOYL)(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NC4CCCC4)C(=O)O)C
InChI=1SC23H30N2O4Sc1121016(17(23(28)29)1113(12)2)20(26)252219(1585918(15)3022)21(27)2414634714h141617H311H212H3(H2427)(H2526)(H2829)
MFCD06021572
ZINC000017097120
ZINC000017097123
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