Vitas-M small molecule compound
trans-N-(1,3-benzodioxol-5-yl)-4-[(L-methionylamino)methyl]cyclohexanecarboxamide
Catalog ID
STL529618
SMILES CSCC[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)Nc1ccc2c(c1)OCO2)N
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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 C20H29N3O4S MW 407.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O4S/c1-28-9-8-16(21)20(25)22-11-13-2-4-14(5-3-13)19(24)23-15-6-7-17-18(10-15)27-12-26-17/h6-7,10,13-14,16H,2-5,8-9,11-12,21H2,1H3,(H,22,25)(H,23,24)/t13-,14-,16-/m0/s1InChIKey
WNZLJUQGEOKOJG-DZKIICNBSA-NSynonyms
(1S4r)4(((S)2amino4(methylthio)butanamido)methyl)N(benzo(d)(13)dioxol5yl)cyclohexanecarboxamidehydrochloride
CSCC(C@@H)(C(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)Nc1ccc2c(c1)OCO2)NCl
InChI=1SC20H29N3O4Sc1289816(21)20(25)2211132414(5313)19(24)2315671718(1015)27122617h6710131416H2589111221H21H3(H2225)(H2324)t131416m0s1
transN(13benzodioxol5yl)4((Lmethionylamino)methyl)cyclohexanecarboxamide
ZINC000248094038
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