Vitas-M small molecule compound
(6Z)-2-(3,4-dimethoxybenzyl)-5-imino-6-(1H-indol-3-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712799
SMILES COc1cc(ccc1OC)Cc1nn2c(=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 C23H19N5O3S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O3S/c1-30-18-8-7-13(9-19(18)31-2)10-20-27-28-21(24)16(22(29)26-23(28)32-20)11-14-12-25-17-6-4-3-5-15(14)17/h3-9,11-12,24-25H,10H2,1-2H3/b16-11-,24-21-InChIKey
XITAQKVOGXOSPD-QGTZUTPYSA-NSynonyms
(6Z)2(34dimethoxybenzyl)5imino6(1Hindol3ylmethylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6((1Hindol3yl)methylene)2(34dimethoxybenzyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1cc(ccc1OC)Cc1nn2c(=NC(=O)C(=Cc3c(nH)c4c3cccc4)C2=N)s1
MFCD04026097
ZINC000009165476
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