Vitas-M small molecule compound
5-chloro-3'-[(4-chlorobenzyl)sulfanyl]-7'H-spiro[indole-3,6'-[1,2,4]triazino[5,6-d][3,1]benzoxazepin]-2(1H)-one
Catalog ID
STK326304
SMILES Clc1ccc(cc1)CSc1nnc2c(n1)OC1(Nc3c2cccc3)C(=O)Nc2c1cc(Cl)cc2
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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 C24H15Cl2N5O2S MW 508.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15Cl2N5O2S/c25-14-7-5-13(6-8-14)12-34-23-28-21-20(30-31-23)16-3-1-2-4-18(16)29-24(33-21)17-11-15(26)9-10-19(17)27-22(24)32/h1-11,29H,12H2,(H,27,32)InChIKey
VEKUXUQJZRBJMZ-UHFFFAOYSA-NSynonyms
5chloro3((4chlorobenzyl)sulfanyl)7Hspiro(indole36(124)triazino(56d)(31)benzoxazepin)2(1H)one
5CHLORO3((4CHLOROPHENYL)METHYLSULFANYL)SPIRO(1HINDOLE367H(124)TRIAZINO(56D)(31)BENZOXAZEPINE)2ONE
C1=CC=C2C(=C1)C3=C(N=C(N=N3)SCC4=CC=C(C=C4)Cl)OC5(N2)C6=C(C=CC(=C6)Cl)NC5=O
InChI=1SC24H15Cl2N5O2Sc25147513(6814)123423282120(303123)16312418(16)2924(3321)171115(26)91019(17)2722(24)32h11129H12H2(H2732)
MFCD02376934
ZINC000000684372
ZINC000008453111
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