Vitas-M small molecule compound

3-[(2,1,3-benzoxadiazol-5-ylmethyl)sulfanyl]-5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK769468
SMILES c1ccc(cc1)CCn1c2ccccc2c2c1nc(SCc1ccc3c(c1)non3)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 C24H18N6OS MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N6OS/c1-2-6-16(7-3-1)12-13-30-21-9-5-4-8-18(21)22-23(30)25-24(27-26-22)32-15-17-10-11-19-20(14-17)29-31-28-19/h1-11,14H,12-13,15H2
InChIKey
TUBYATAHDVEIRP-UHFFFAOYSA-N
Synonyms

3((213benzoxadiazol5ylmethyl)sulfanyl)5(2phenylethyl)5H(124)triazino(56b)indole
3((213BENZOXADIAZOL5YLMETHYL)THIO)5(2PHENYLETHYL)5H(124)TRIAZINO(56B)INDOLE
3(BENZO(C)125OXADIAZOL5YLMETHYLTHIO)5(2PHENYLETHYL)124TRIAZINO(56B)INDOLE
5((5(2phenylethyl)(124)triazino(56b)indol3yl)sulfanylmethyl)213benzoxadiazole
5((5PHENETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYLMETHYL)213BENZOXADIAZOLE
C1=CC=C(C=C1)CCN2C3=CC=CC=C3C4=C2N=C(N=N4)SCC5=CC6=NON=C6C=C5
InChI=1SC24H18N6OSc12616(731)12133021954818(21)2223(30)2524(272622)32151710111920(1417)29312819h11114H121315H2
MFCD03409139
ZINC000000720900
ZINC00720900
ZINC720900

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Available files

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