Vitas-M small molecule compound
(6E)-6-{[2,5-dimethyl-1-(naphthalen-2-yl)-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
STL224657
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1ccc2c(c1)cccc2)C)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 C26H19N5O2S MW 465.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N5O2S/c1-15-12-19(16(2)30(15)20-10-9-17-6-3-4-7-18(17)13-20)14-21-23(27)31-26(28-24(21)32)34-25(29-31)22-8-5-11-33-22/h3-14,27H,1-2H3/b21-14+,27-23-InChIKey
KWIBKULNHVZWJD-UDAXPUTOSA-NSynonyms
845983-55-3(6E)6((25dimethyl1(naphthalen2yl)1Hpyrrol3yl)methylidene)2(furan2yl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(naphthalen2yl)1Hpyrrol3yl)methylene)2(furan2yl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
845983553
MFCD04171214
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1ccc2c(c1)cccc2)C)c1ccco1
ZINC000009282606
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