Vitas-M small molecule compound
methyl N-{(2-methoxyethyl)[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]carbamothioyl}methioninate
Catalog ID
STK633881
SMILES COCCN(C(=S)NC(C(=O)OC)CCSC)Cc1cc(=O)[nH]c2c1cccc2
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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 C20H27N3O4S2 MW 437.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O4S2/c1-26-10-9-23(20(28)22-17(8-11-29-3)19(25)27-2)13-14-12-18(24)21-16-7-5-4-6-15(14)16/h4-7,12,17H,8-11,13H2,1-3H3,(H,21,24)(H,22,28)InChIKey
OCBLUHRWETXJKB-UHFFFAOYSA-NSynonyms
COCCN(C(=S)NC(C(=O)OC)CCSC)Cc1cc(=O)(nH)c2c1cccc2
COCCN(CC1=CC(=O)NC2=CC=CC=C21)C(=S)NC(CCSC)C(=O)OC
InChI=1SC20H27N3O4S2c12610923(20(28)2217(811293)19(25)272)13141218(24)2116754615(14)16h471217H81113H213H3(H2124)(H2228)
methyl2((2methoxyethyl((2oxo1Hquinolin4yl)methyl)carbamothioyl)amino)4methylsulfanylbutanoate
methylN((2methoxyethyl)((2oxo12dihydroquinolin4yl)methyl)carbamothioyl)methioninate
MFCD18160231
ZINC000013731275
ZINC000036569310
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