Vitas-M small molecule compound
(6E)-5-imino-6-({1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK657033
SMILES CCC(c1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)CCOc3ccccc3C)/C2=N)s1)CC
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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 C28H29N5O2S MW 499.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O2S/c1-4-19(5-2)27-31-33-25(29)22(26(34)30-28(33)36-27)16-20-17-32(23-12-8-7-11-21(20)23)14-15-35-24-13-9-6-10-18(24)3/h6-13,16-17,19,29H,4-5,14-15H2,1-3H3/b22-16+,29-25-InChIKey
SYNPAJUUZUCUPB-YSKLIXNHSA-NSynonyms
850156-71-7(6E)5imino6((1(2(2methylphenoxy)ethyl)1Hindol3yl)methylidene)2(pentan3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino2(pentan3yl)6((1(2(otolyloxy)ethyl)1Hindol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850156717
CCC(c1nn2c(=NC(=O)C(=Cc3cn(c4c3cccc4)CCOc3ccccc3C)C2=N)s1)CC
MFCD05689714
ZINC000009309685
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