Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}butan-1-one
Catalog ID
STK723627
SMILES C=CCn1c2ccccc2c2c1nc(SCCCC(=O)c1ccc3c(c1)OCCO3)nn2
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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 C24H22N4O3S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3S/c1-2-11-28-18-7-4-3-6-17(18)22-23(28)25-24(27-26-22)32-14-5-8-19(29)16-9-10-20-21(15-16)31-13-12-30-20/h2-4,6-7,9-10,15H,1,5,8,11-14H2InChIKey
OGVUCKXDLHEKKT-UHFFFAOYSA-NSynonyms
1(23dihydro14benzodioxin6yl)4((5(prop2en1yl)5H(124)triazino(56b)indol3yl)sulfanyl)butan1one
1(23DIHYDRO14BENZODIOXIN6YL)4((5PROP2ENYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTAN1ONE
C=CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCCCC(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC24H22N4O3Sc12112818743617(18)2223(28)2524(272622)32145819(29)169102021(1516)3113123020h246791015H1581114H2
MFCD05856847
ZINC000006073591
ZINC06073591
ZINC6073591
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