Vitas-M small molecule compound
methyl (2E)-2-[({1-[2-(2-methoxyphenyl)ethyl]-5-oxopyrrolidin-3-yl}carbonyl)imino]-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL407877
SMILES COC(=O)c1s/c(=N/C(=O)C2CN(C(=O)C2)CCc2ccccc2OC)/[nH]c1C
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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 C20H23N3O5S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5S/c1-12-17(19(26)28-3)29-20(21-12)22-18(25)14-10-16(24)23(11-14)9-8-13-6-4-5-7-15(13)27-2/h4-7,14H,8-11H2,1-3H3,(H,21,22,25)InChIKey
BLXLHEMSFPNNGV-UHFFFAOYSA-NSynonyms
1574481-04-11574481041
CC1=C(SC(=N1)NC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3OC)C(=O)OC
COC(=O)c1sc(=NC(=O)C2CN(C(=O)C2)CCc2ccccc2OC)(nH)c1C
InChI=1SC20H23N3O5Sc11217(19(26)283)2920(2112)2218(25)141016(24)23(1114)9813645715(13)272h4714H811H213H3(H212225)
methyl(2E)2(((1(2(2methoxyphenyl)ethyl)5oxopyrrolidin3yl)carbonyl)imino)4methyl23dihydro13thiazole5carboxylate
methyl2((1(2(2methoxyphenyl)ethyl)5oxopyrrolidine3carbonyl)amino)4methyl13thiazole5carboxylate
MFCD30704949
ZINC000096118536
ZINC000096118537
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