Vitas-M small molecule compound
tert-butyl [(5E)-5-{[2,5-dimethyl-1-(pyridin-2-yl)-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STL388533
SMILES O=C(OC(C)(C)C)CN1C(=O)S/C(=C/c2cc(n(c2C)c2ccccn2)C)/C1=O
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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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-13-10-15(14(2)24(13)17-8-6-7-9-22-17)11-16-19(26)23(20(27)29-16)12-18(25)28-21(3,4)5/h6-11H,12H2,1-5H3/b16-11+InChIKey
DTTLTABZZRJTRI-LFIBNONCSA-NSynonyms
CC1=CC(=C(N1C2=CC=CC=N2)C)C=C3C(=O)N(C(=O)S3)CC(=O)OC(C)(C)C
InChI=1SC21H23N3O4Sc1131015(14(2)24(13)1786792217)111619(26)23(20(27)2916)1218(25)2821(34)5h611H12H215H3b1611+
MFCD07394007
O=C(OC(C)(C)C)CN1C(=O)SC(=Cc2cc(n(c2C)c2ccccn2)C)C1=O
tertbutyl((5E)5((25dimethyl1(pyridin2yl)1Hpyrrol3yl)methylidene)24dioxo13thiazolidin3yl)acetate
TERTBUTYL2((5E)5((25DIMETHYL1PYRIDIN2YLPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ZINC000004933343
ZINC04933343
ZINC4933343
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