Vitas-M small molecule compound
(6E)-6-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL349430
SMILES CCc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
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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 C26H28N6O2S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O2S/c1-4-18-7-9-20(10-8-18)31-16(2)13-19(17(31)3)14-21-24(27)32-26(28-25(21)34)35-22(29-32)15-23(33)30-11-5-6-12-30/h7-10,13-14,27H,4-6,11-12,15H2,1-3H3/b21-14+,27-24-InChIKey
DJEFBAJWQZHMFP-ZDGMEELJSA-NSynonyms
865790-08-5(6E)6((1(4ethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(4ethylphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
865790085
CCc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD05706183
ZINC000009293682
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