Vitas-M small molecule compound
(6Z)-2-heptyl-5-imino-6-(1H-indol-3-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK767370
SMILES CCCCCCCc1nn2c(=NC(=O)/C(=C\c3c[nH]c4c3cccc4)/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 C21H23N5OS MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5OS/c1-2-3-4-5-6-11-18-25-26-19(22)16(20(27)24-21(26)28-18)12-14-13-23-17-10-8-7-9-15(14)17/h7-10,12-13,22-23H,2-6,11H2,1H3/b16-12-,22-19-InChIKey
LLPDYUAFQLUIRO-AAMDCLCLSA-NSynonyms
(6Z)2heptyl5imino6(1Hindol3ylmethylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1Hindol3yl)methylene)2heptyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCCCCCCc1nn2c(=NC(=O)C(=Cc3c(nH)c4c3cccc4)C2=N)s1
MFCD02955420
ZINC000100112915
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