Vitas-M small molecule compound
(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl {[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetate
Catalog ID
STK523921
SMILES O=C(OCN1C(=O)c2c(C1=O)cccc2)CSc1nnc2c(n1)n(CCc1ccccc1)c1c2cccc1
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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 C28H21N5O4S MW 523.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N5O4S/c34-23(37-17-33-26(35)19-10-4-5-11-20(19)27(33)36)16-38-28-29-25-24(30-31-28)21-12-6-7-13-22(21)32(25)15-14-18-8-2-1-3-9-18/h1-13H,14-17H2InChIKey
SWFIVIXZBNNVCC-UHFFFAOYSA-NSynonyms
296896-37-2(13dioxo13dihydro2Hisoindol2yl)methyl((5(2phenylethyl)5H(124)triazino(56b)indol3yl)sulfanyl)acetate
(13dioxoisoindol2yl)methyl2((5(2phenylethyl)(124)triazino(56b)indol3yl)sulfanyl)acetate
(13DIOXOISOINDOL2YL)METHYL2((5PHENETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETATE
296896372
C1=CC=C(C=C1)CCN2C3=CC=CC=C3C4=C2N=C(N=N4)SCC(=O)OCN5C(=O)C6=CC=CC=C6C5=O
InChI=1SC28H21N5O4Sc3423(37173326(35)1910451120(19)27(33)36)163828292524(303128)2112671322(21)32(25)1514188213918h113H1417H2
MFCD01572261
ZINC000001063401
ZINC1063401
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