Vitas-M small molecule compound
ethyl 4-[(E)-[4,5-dioxo-1-(pyridin-3-ylmethyl)-2-(thiophen-2-yl)pyrrolidin-3-ylidene](hydroxy)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Catalog ID
STK635631
SMILES CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)Cc1cccnc1)/O)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 C24H23N3O5S MW 465.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5S/c1-4-32-24(31)19-13(2)17(14(3)26-19)21(28)18-20(16-8-6-10-33-16)27(23(30)22(18)29)12-15-7-5-9-25-11-15/h5-11,20,26,28H,4,12H2,1-3H3/b21-18+InChIKey
VLZVBASHIQAHPQ-DYTRJAOYSA-NSynonyms
951993-70-7951993707
CCOC(=O)c1(nH)c(c(c1C)C(=C1C(=O)C(=O)N(C1c1cccs1)Cc1cccnc1)O)C
CCOC(=O)C1=C(C(=C(N1)C)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=CS4)O)C
ethyl4((E)(45dioxo1(pyridin3ylmethyl)2(thiophen2yl)pyrrolidin3ylidene)(hydroxy)methyl)35dimethyl1Hpyrrole2carboxylate
ethyl4((E)(45dioxo1(pyridin3ylmethyl)2thiophen2ylpyrrolidin3ylidene)hydroxymethyl)35dimethyl1Hpyrrole2carboxylate
InChI=1SC24H23N3O5Sc143224(31)1913(2)17(14(3)2619)21(28)1820(1686103316)27(23(30)22(18)29)1215759251115h511202628H412H213H3b2118+
MFCD18160795
ZINC000102739559
ZINC000102739561
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