Vitas-M small molecule compound
(6E)-5-imino-6-({1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK556867
SMILES O=C(N1CCCC1)Cc1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)CCOc3ccccc3C)/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 C29H28N6O3S MW 540.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O3S/c1-19-8-2-5-11-24(19)38-15-14-34-18-20(21-9-3-4-10-23(21)34)16-22-27(30)35-29(31-28(22)37)39-25(32-35)17-26(36)33-12-6-7-13-33/h2-5,8-11,16,18,30H,6-7,12-15,17H2,1H3/b22-16+,30-27-InChIKey
KUVFUPBIWMUHLF-GOWCKZLZSA-NSynonyms
573947-21-4(6E)5imino6((1(2(2methylphenoxy)ethyl)1Hindol3yl)methylidene)2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino2(2oxo2(pyrrolidin1yl)ethyl)6((1(2(otolyloxy)ethyl)1Hindol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
573947214
MFCD04021064
O=C(N1CCCC1)Cc1nn2c(=NC(=O)C(=Cc3cn(c4c3cccc4)CCOc3ccccc3C)C2=N)s1
ZINC000101061752
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