Vitas-M small molecule compound

(6E)-6-[(1-benzyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-5-imino-2-(2-methylpropyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Catalog ID
STL224323
SMILES CC(Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)Cc3ccccc3)C)/C2=N)s1)C

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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 C23H25N5OS MW 419.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5OS/c1-14(2)10-20-26-28-21(24)19(22(29)25-23(28)30-20)12-18-11-15(3)27(16(18)4)13-17-8-6-5-7-9-17/h5-9,11-12,14,24H,10,13H2,1-4H3/b19-12+,24-21-
InChIKey
LJNXYMOPDIRGLS-KBEOOMRJSA-N
Synonyms
848928-96-1
(6E)6((1benzyl25dimethyl1Hpyrrol3yl)methylidene)5imino2(2methylpropyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1benzyl25dimethyl1Hpyrrol3yl)methylene)5imino2isobutyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848928961
CC(Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)Cc3ccccc3)C)C2=N)s1)C
MFCD05678025
ZINC000005295554

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Available files

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