Vitas-M small molecule compound
N-[(2R)-1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-methyl-1-oxobutan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Catalog ID
STK638500
SMILES COc1cc(CCNC(=O)[C@@H](C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(cc2)C)ccc1OC
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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 C28H39N3O6S MW 545.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H39N3O6S/c1-19(2)26(28(33)29-15-12-21-8-11-24(36-4)25(18-21)37-5)30-27(32)22-13-16-31(17-14-22)38(34,35)23-9-6-20(3)7-10-23/h6-11,18-19,22,26H,12-17H2,1-5H3,(H,29,33)(H,30,32)/t26-/m1/s1InChIKey
BOFASFQAHTYTIV-AREMUKBSSA-NSynonyms
(S)N(1((34dimethoxyphenethyl)amino)3methyl1oxobutan2yl)1tosylpiperidine4carboxamide
CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)NCCC3=CC(=C(C=C3)OC)OC
COc1cc(CCNC(=O)(C@@H)(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(cc2)C)ccc1OC
COc1cc(CCNC(=O)(C@H)(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(cc2)C)ccc1OC
InChI=1SC28H39N3O6Sc119(2)26(28(33)2915122181124(364)25(1821)375)3027(32)22131631(171422)38(3435)239620(3)71023h61118192226H1217H215H3(H2933)(H3032)t26m1s1
MFCD18161708
N((2R)1((2(34dimethoxyphenyl)ethyl)amino)3methyl1oxobutan2yl)1((4methylphenyl)sulfonyl)piperidine4carboxamide
N((2R)1(2(34dimethoxyphenyl)ethylamino)3methyl1oxobutan2yl)1(4methylphenyl)sulfonylpiperidine4carboxamide
ZINC000102743019
ZINC102743019
Check stock
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Check stock on Vitas-MAvailable files
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