Vitas-M small molecule compound
6,7-dimethoxy-N-[(2S)-4-methyl-1-oxo-1-(1,3-thiazol-2-ylamino)pentan-2-yl]-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STK617852
SMILES COc1cc2CN(CCc2cc1OC)C(=O)N[C@H](C(=O)Nc1nccs1)CC(C)C
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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 C21H28N4O4S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O4S/c1-13(2)9-16(19(26)24-20-22-6-8-30-20)23-21(27)25-7-5-14-10-17(28-3)18(29-4)11-15(14)12-25/h6,8,10-11,13,16H,5,7,9,12H2,1-4H3,(H,23,27)(H,22,24,26)/t16-/m0/s1InChIKey
KARMEGCYCTZNRB-INIZCTEOSA-NSynonyms
(S)67dimethoxyN(4methyl1oxo1(thiazol2ylamino)pentan2yl)34dihydroisoquinoline2(1H)carboxamide
67dimethoxyN((2S)4methyl1oxo1(13thiazol2ylamino)pentan2yl)34dihydro1Hisoquinoline2carboxamide
67dimethoxyN((2S)4methyl1oxo1(13thiazol2ylamino)pentan2yl)34dihydroisoquinoline2(1H)carboxamide
CC(C)CC(C(=O)NC1=NC=CS1)NC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC
COc1cc2CN(CCc2cc1OC)C(=O)N(C@H)(C(=O)Nc1nccs1)CC(C)C
InChI=1SC21H28N4O4Sc113(2)916(19(26)242022683020)2321(27)2575141017(283)18(294)1115(14)1225h6810111316H57912H214H3(H2327)(H222426)t16m0s1
MFCD08749214
ZINC000013629287
ZINC13629287
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