Vitas-M small molecule compound
3-({4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK479967
SMILES OC(=O)C1C2CCC(C1C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C2
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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 C20H26N2O5S MW 406.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O5S/c1-13-2-6-16(7-3-13)28(26,27)22-10-8-21(9-11-22)19(23)17-14-4-5-15(12-14)18(17)20(24)25/h2-3,6-7,14-15,17-18H,4-5,8-12H2,1H3,(H,24,25)InChIKey
FBEODZGDFTZKIJ-UHFFFAOYSA-NSynonyms
2(4(4methylphenyl)sulfonylpiperazine1carbonyl)bicyclo(221)heptane3carboxylicacid
3((4((4methylphenyl)sulfonyl)piperazin1yl)carbonyl)bicyclo(221)heptane2carboxylicacid
3((4((4METHYLPHENYL)SULFONYL)PIPERAZINYL)CARBONYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3C4CCC(C4)C3C(=O)O
InChI=1SC20H26N2O5Sc1132616(7313)28(2627)2210821(91122)19(23)17144515(1214)18(17)20(24)25h236714151718H45812H21H3(H2425)
MFCD06066420
ZINC000102361337
ZINC000138056090
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