Vitas-M small molecule compound
(6Z)-6-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK026204
SMILES CCc1nn2c(=NC(=O)/C(=C\c3cc(n(c3C)c3ccc(cc3)Br)C)/C2=N)s1
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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 C20H18BrN5OS MW 456.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN5OS/c1-4-17-24-26-18(22)16(19(27)23-20(26)28-17)10-13-9-11(2)25(12(13)3)15-7-5-14(21)6-8-15/h5-10,22H,4H2,1-3H3/b16-10-,22-18-InChIKey
RNYAPNHAMCEWIO-OOVWLKTBSA-NSynonyms
(6Z)6((1(4bromophenyl)25dimethyl1Hpyrrol3yl)methylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc(cc3)Br)C)C2=N)s1
MFCD08050066
STK026204
ZINC000009113653
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