Vitas-M small molecule compound
(6E)-6-{[1-(2-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(furan-2-yl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224602
SMILES CCOc1ccccc1n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1ccco1
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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 C24H21N5O3S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O3S/c1-4-31-19-9-6-5-8-18(19)28-14(2)12-16(15(28)3)13-17-21(25)29-24(26-22(17)30)33-23(27-29)20-10-7-11-32-20/h5-13,25H,4H2,1-3H3/b17-13+,25-21-InChIKey
YXBXANBWEAWTCD-JGMLIKJUSA-NSynonyms
850188-10-2(6E)6((1(2ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(furan2yl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(furan2yl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850188102
CCOc1ccccc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccco1
MFCD05690339
ZINC000009309717
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