Vitas-M small molecule compound
N,N-dimethyl-4-{3-[(4-methylbenzyl)sulfanyl]-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl}aniline
Catalog ID
STK326290
SMILES Cc1ccc(cc1)CSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(cc1)N(C)C
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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 C26H25N5OS MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5OS/c1-17-8-10-18(11-9-17)16-33-26-28-25-23(29-30-26)21-6-4-5-7-22(21)27-24(32-25)19-12-14-20(15-13-19)31(2)3/h4-15,24,27H,16H2,1-3H3InChIKey
QCNVRUGGDXCLBD-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CSC2=NC3=C(C4=CC=CC=C4NC(O3)C5=CC=C(C=C5)N(C)C)N=N2
InChI=1SC26H25N5OSc11781018(11917)163326282523(293026)21645722(21)2724(3225)19121420(151319)31(2)3h4152427H16H213H3
MFCD02326654
NNdimethyl4(3((4methylbenzyl)sulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepin6yl)aniline
NNDIMETHYL4(3((4METHYLPHENYL)METHYLSULFANYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPIN6YL)ANILINE
ZINC000002094653
ZINC000002094656
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