Vitas-M small molecule compound
(6Z)-2-(2-cyclohexylethyl)-5-imino-6-(1H-indol-3-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL225015
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1c[nH]c2c1cccc2)CCC1CCCCC1
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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 C22H23N5OS MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5OS/c23-20-17(12-15-13-24-18-9-5-4-8-16(15)18)21(28)25-22-27(20)26-19(29-22)11-10-14-6-2-1-3-7-14/h4-5,8-9,12-14,23-24H,1-3,6-7,10-11H2/b17-12-,23-20-InChIKey
RTTPILCNHQSEPO-NSMLSGJHSA-NSynonyms
(6Z)2(2cyclohexylethyl)5imino6(1Hindol3ylmethylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1Hindol3yl)methylene)2(2cyclohexylethyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD24857995
O=C1N=c2sc(nn2C(=N)C1=Cc1c(nH)c2c1cccc2)CCC1CCCCC1
ZINC000041084891
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