Vitas-M small molecule compound
6-({4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}carbonyl)-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK463673
SMILES Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)C1CC(=C(CC1C(=O)O)C)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 C20H25ClN2O5S MW 440.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN2O5S/c1-13-11-17(18(20(25)26)12-14(13)2)19(24)22-7-9-23(10-8-22)29(27,28)16-5-3-15(21)4-6-16/h3-6,17-18H,7-12H2,1-2H3,(H,25,26)InChIKey
INCUSDBSWJWDFB-UHFFFAOYSA-NSynonyms
6((4((4chlorophenyl)sulfonyl)piperazin1yl)carbonyl)34dimethylcyclohex3ene1carboxylicacid
6((4((4CHLOROPHENYL)SULFONYL)PIPERAZINYL)CARBONYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
6(4(4chlorophenyl)sulfonylpiperazine1carbonyl)34dimethylcyclohex3ene1carboxylicacid
CC1=C(CC(C(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)O)C
InChI=1SC20H25ClN2O5Sc1131117(18(20(25)26)1214(13)2)19(24)227923(10822)29(2728)165315(21)4616h361718H712H212H3(H2526)
MFCD06066419
ZINC000019632762
ZINC000019632775
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