Vitas-M small molecule compound
methyl N-{[4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidin-1-yl]carbonyl}-L-methioninate
Catalog ID
STL008730
SMILES CSCC[C@@H](C(=O)OC)NC(=O)N1CC/C(=C/2\c3ccc(cc3CCc3c2nccc3)Cl)/CC1
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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 C26H30ClN3O3S MW 500.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30ClN3O3S/c1-33-25(31)22(11-15-34-2)29-26(32)30-13-9-17(10-14-30)23-21-8-7-20(27)16-19(21)6-5-18-4-3-12-28-24(18)23/h3-4,7-8,12,16,22H,5-6,9-11,13-15H2,1-2H3,(H,29,32)/t22-/m0/s1InChIKey
FLULVLCYCBVORD-QFIPXVFZSA-NSynonyms
1013754-07-8(S)methyl2(4(8chloro5Hbenzo(56)cyclohepta(12b)pyridin11(6H)ylidene)piperidine1carboxamido)4(methylthio)butanoate
1013754078
COC(=O)C(CCSC)NC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1
CSCC(C@@H)(C(=O)OC)NC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1
InChI=1SC26H30ClN3O3Sc13325(31)22(1115342)2926(32)3013917(101430)23218720(27)1619(21)651843122824(18)23h3478121622H569111315H212H3(H2932)t22m0s1
methyl(2S)2((4(8chloro56dihydrobenzo(12)cyclohepta(24b)pyridin11ylidene)piperidine1carbonyl)amino)4methylsulfanylbutanoate
methylN((4(8chloro56dihydro11Hbenzo(56)cyclohepta(12b)pyridin11ylidene)piperidin1yl)carbonyl)Lmethioninate
MFCD09848936
ZINC000008993244
ZINC08993244
ZINC8993244
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.