Vitas-M small molecule compound
(6E)-6-({2,5-dimethyl-1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-(3-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK020794
SMILES Cc1cccc(c1)c1sc2=NC(=O)/C(=C/c3c4cc(C)ccc4n(c3C)CCOc3ccccc3C)/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 C32H29N5O2S MW 547.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O2S/c1-19-8-7-10-23(16-19)31-35-37-29(33)26(30(38)34-32(37)40-31)18-24-22(4)36(27-13-12-20(2)17-25(24)27)14-15-39-28-11-6-5-9-21(28)3/h5-13,16-18,33H,14-15H2,1-4H3/b26-18+,33-29-InChIKey
SMHJLEOESKACDJ-GPTMJPEHSA-NSynonyms
(6E)6((25dimethyl1(2(2methylphenoxy)ethyl)1Hindol3yl)methylidene)5imino2(3methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
Cc1cccc(c1)c1sc2=NC(=O)C(=Cc3c4cc(C)ccc4n(c3C)CCOc3ccccc3C)C(=N)n2n1
MFCD08049839
STK020794
ZINC000097958027
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