Vitas-M small molecule compound
methyl (2Z)-2-({[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]carbonyl}imino)-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL315890
SMILES CCOC(=O)c1[nH]c(c(c1C)C(=O)/N=c\1/[nH]c(c(s1)CC(C)C)C(=O)OC)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 C19H25N3O5S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O5S/c1-7-27-18(25)14-10(4)13(11(5)20-14)16(23)22-19-21-15(17(24)26-6)12(28-19)8-9(2)3/h9,20H,7-8H2,1-6H3,(H,21,22,23)InChIKey
ZFOHEXHKHKTFIP-UHFFFAOYSA-NSynonyms
1574495-75-21574495752
CCOC(=O)c1(nH)c(c(c1C)C(=O)N=c1(nH)c(c(s1)CC(C)C)C(=O)OC)C
CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=NC(=C(S2)CC(C)C)C(=O)OC)C
InChI=1SC19H25N3O5Sc172718(25)1410(4)13(11(5)2014)16(23)22192115(17(24)266)12(2819)89(2)3h920H78H216H3(H212223)
methyl(2Z)2(((5(ethoxycarbonyl)24dimethyl1Hpyrrol3yl)carbonyl)imino)5(2methylpropyl)23dihydro13thiazole4carboxylate
methyl2((5ethoxycarbonyl24dimethyl1Hpyrrole3carbonyl)amino)5(2methylpropyl)13thiazole4carboxylate
MFCD28027510
ZINC000095477359
ZINC95477359
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