Vitas-M small molecule compound
N,N-diethyl-4-[3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]aniline
Catalog ID
STL482808
SMILES CCN(c1ccc(cc1)C1Nc2ccccc2c2c(O1)nc(SC)nn2)CC
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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 C21H23N5OS MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5OS/c1-4-26(5-2)15-12-10-14(11-13-15)19-22-17-9-7-6-8-16(17)18-20(27-19)23-21(28-3)25-24-18/h6-13,19,22H,4-5H2,1-3H3InChIKey
PBBQXLZGOFZIOY-UHFFFAOYSA-NSynonyms
CCN(CC)C1=CC=C(C=C1)C2NC3=CC=CC=C3C4=C(O2)N=C(N=N4)SC
InChI=1SC21H23N5OSc1426(52)15121014(111315)192217976816(17)1820(2719)2321(283)252418h6131922H45H213H3
MFCD00615477
NNdiethyl4(3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepin6yl)aniline
NNDIETHYL4(3METHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPIN6YL)ANILINE
ZINC000001409513
ZINC000001409514
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