Vitas-M small molecule compound

6-(4-methoxy-3-methylphenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Catalog ID
STL169749
SMILES COc1ccc(cc1C)C1Nc2ccccc2c2c(O1)nc(SC)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 C19H18N4O2S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S/c1-11-10-12(8-9-15(11)24-2)17-20-14-7-5-4-6-13(14)16-18(25-17)21-19(26-3)23-22-16/h4-10,17,20H,1-3H3
InChIKey
QUKUMJFNORPEEA-UHFFFAOYSA-N
Synonyms
354544-32-4
354544324
6(4methoxy3methylphenyl)3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(4METHOXY3METHYLPHENYL)3METHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CC1=C(C=CC(=C1)C2NC3=CC=CC=C3C4=C(O2)N=C(N=N4)SC)OC
InChI=1SC19H18N4O2Sc1111012(8915(11)242)172014754613(14)1618(2517)2119(263)232216h4101720H13H3
MFCD01161572
ZINC000004123915
ZINC000004123916

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Available files

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