Vitas-M small molecule compound
(6E)-6-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-heptyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL303018
SMILES CCCCCCCc1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3CC)C)/C(=N)n2n1
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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 C27H33N5OS MW 475.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N5OS/c1-5-7-8-9-10-15-24-30-32-25(28)22(26(33)29-27(32)34-24)17-21-16-18(3)31(19(21)4)23-14-12-11-13-20(23)6-2/h11-14,16-17,28H,5-10,15H2,1-4H3/b22-17+,28-25-InChIKey
GHISXYXACKJION-YFQBKBOHSA-NSynonyms
848989-49-1(6E)6((1(2ethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)2heptyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2ethylphenyl)25dimethyl1Hpyrrol3yl)methylene)2heptyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848989491
CCCCCCCc1sc2=NC(=O)C(=Cc3cc(n(c3C)c3ccccc3CC)C)C(=N)n2n1
MFCD05678845
ZINC000101180103
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