Vitas-M small molecule compound
(6Z)-2-ethyl-5-imino-6-[(1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK828075
SMILES C=CCc1ccccc1OCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
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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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-3-9-18-10-5-8-13-23(18)34-15-14-31-17-19(20-11-6-7-12-22(20)31)16-21-25(28)32-27(29-26(21)33)35-24(4-2)30-32/h3,5-8,10-13,16-17,28H,1,4,9,14-15H2,2H3/b21-16-,28-25-InChIKey
RNDZIIHPKWRTOQ-KHZAZHPGSA-NSynonyms
(6Z)2ethyl5imino6((1(2(2(prop2en1yl)phenoxy)ethyl)1Hindol3yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2(2allylphenoxy)ethyl)1Hindol3yl)methylene)2ethyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
C=CCc1ccccc1OCCn1cc(c2c1cccc2)C=C1C(=O)N=c2n(C1=N)nc(s2)CC
MFCD02109923
ZINC000033148383
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