Vitas-M small molecule compound
(6Z)-5-imino-6-({1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK828149
SMILES COc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)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 C26H25N5O3S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O3S/c1-16(2)25-29-31-23(27)21(24(32)28-26(31)35-25)14-17-15-30(22-7-5-4-6-20(17)22)12-13-34-19-10-8-18(33-3)9-11-19/h4-11,14-16,27H,12-13H2,1-3H3/b21-14-,27-23-InChIKey
SLQBXZVPJCBEBE-XYKRTHMNSA-NSynonyms
(6Z)5imino6((1(2(4methoxyphenoxy)ethyl)1Hindol3yl)methylidene)2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino2isopropyl6((1(2(4methoxyphenoxy)ethyl)1Hindol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1ccc(cc1)OCCn1cc(c2c1cccc2)C=C1C(=O)N=c2n(C1=N)nc(s2)C(C)C
MFCD02955433
ZINC000008450592
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