Vitas-M small molecule compound
(6E)-6-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL225060
SMILES CCC(c1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cccc4c3cccc4)C)/C2=N)s1)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 C27H27N5OS MW 469.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5OS/c1-5-18(6-2)26-30-32-24(28)22(25(33)29-27(32)34-26)15-20-14-16(3)31(17(20)4)23-13-9-11-19-10-7-8-12-21(19)23/h7-15,18,28H,5-6H2,1-4H3/b22-15+,28-24-InChIKey
HDYQFBUGGHBZTQ-ZNBHHVKPSA-NSynonyms
844830-60-0(6E)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)5imino2(pentan3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylene)5imino2(pentan3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844830600
CCC(c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cccc4c3cccc4)C)C2=N)s1)CC
MFCD04161811
ZINC000009193218
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