Vitas-M small molecule compound
methyl (2Z)-2-({[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]carbonyl}imino)-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL316611
SMILES COCCn1cc(C(=O)/N=c\2/[nH]c(c(s2)C)C(=O)OC)c2c(c1=O)cccc2
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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 C19H19N3O5S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S/c1-11-15(18(25)27-3)20-19(28-11)21-16(23)14-10-22(8-9-26-2)17(24)13-7-5-4-6-12(13)14/h4-7,10H,8-9H2,1-3H3,(H,20,21,23)InChIKey
XEIXXNCBFGNSKV-UHFFFAOYSA-NSynonyms
1401585-22-51401585225
CC1=C(N=C(S1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)CCOC)C(=O)OC
COCCn1cc(C(=O)N=c2(nH)c(c(s2)C)C(=O)OC)c2c(c1=O)cccc2
InChI=1SC19H19N3O5Sc11115(18(25)273)2019(2811)2116(23)141022(89262)17(24)13754612(13)14h4710H89H213H3(H202123)
methyl(2Z)2(((2(2methoxyethyl)1oxo12dihydroisoquinolin4yl)carbonyl)imino)5methyl23dihydro13thiazole4carboxylate
methyl2((2(2methoxyethyl)1oxoisoquinoline4carbonyl)amino)5methyl13thiazole4carboxylate
MFCD28027911
ZINC000079478784
ZINC79478784
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