Vitas-M small molecule compound
(2Z)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-6-(4-methylbenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK705682
SMILES CCCCN1C(=O)/C(=c/2\sc3n(c2=O)nc(c(=O)n3)Cc2ccc(cc2)C)/c2c1cccc2
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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 C25H22N4O3S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3S/c1-3-4-13-28-19-8-6-5-7-17(19)20(23(28)31)21-24(32)29-25(33-21)26-22(30)18(27-29)14-16-11-9-15(2)10-12-16/h5-12H,3-4,13-14H2,1-2H3/b21-20-InChIKey
DNHCWBYXQFHCNY-MRCUWXFGSA-NSynonyms
(2Z)2(1butyl2oxo12dihydro3Hindol3ylidene)6(4methylbenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2Z)2(1BUTYL2OXOINDOL3YLIDENE)6((4METHYLPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
CCCCN1C(=O)C(=c2sc3n(c2=O)nc(c(=O)n3)Cc2ccc(cc2)C)c2c1cccc2
CCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=C(C=C5)C)S3)C1=O
InChI=1SC25H22N4O3Sc134132819865717(19)20(23(28)31)2124(32)2925(3321)2622(30)18(2729)141611915(2)101216h512H341314H212H3b2120
MFCD03535593
ZINC000015229624
ZINC15229624
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