Vitas-M small molecule compound
(6E)-6-[(1-benzyl-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
STK557429
SMILES O=C(N1CCCC1)Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)Cc3ccccc3)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 C25H26N6O2S MW 474.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N6O2S/c1-16-12-19(17(2)30(16)15-18-8-4-3-5-9-18)13-20-23(26)31-25(27-24(20)33)34-21(28-31)14-22(32)29-10-6-7-11-29/h3-5,8-9,12-13,26H,6-7,10-11,14-15H2,1-2H3/b20-13+,26-23-InChIKey
SBJPGCMEQJCVSB-VOYPSTMSSA-NSynonyms
578759-07-6(6E)6((1benzyl25dimethyl1Hpyrrol3yl)methylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1benzyl25dimethyl1Hpyrrol3yl)methylene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
578759076
MFCD04025320
O=C(N1CCCC1)Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)Cc3ccccc3)C)C2=N)s1
ZINC000009424639
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