Vitas-M small molecule compound
(6E)-5-imino-6-{[1-(3-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(thiophen-2-ylmethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224767
SMILES COc1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)Cc1cccs1
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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 C24H21N5O2S2 MW 475.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O2S2/c1-14-10-16(15(2)28(14)17-6-4-7-18(12-17)31-3)11-20-22(25)29-24(26-23(20)30)33-21(27-29)13-19-8-5-9-32-19/h4-12,25H,13H2,1-3H3/b20-11+,25-22-InChIKey
GZOPDQFOXKJZOA-RSQFKHFRSA-NSynonyms
850901-39-2(6E)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(thiophen2ylmethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(thiophen2ylmethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850901392
COc1cccc(c1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)Cc1cccs1
MFCD05695985
ZINC000009291692
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