Vitas-M small molecule compound
6-[5-(3-chlorophenyl)furan-2-yl]-3-(hexylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK326750
SMILES CCCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(o1)c1cccc(c1)Cl
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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 C26H25ClN4O2S MW 493.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O2S/c1-2-3-4-7-15-34-26-29-25-23(30-31-26)19-11-5-6-12-20(19)28-24(33-25)22-14-13-21(32-22)17-9-8-10-18(27)16-17/h5-6,8-14,16,24,28H,2-4,7,15H2,1H3InChIKey
KRMCKRZEHNVXCP-UHFFFAOYSA-NSynonyms
6(5(3chlorophenyl)furan2yl)3(hexylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(5(3CHLOROPHENYL)FURAN2YL)3HEXYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=C(O4)C5=CC(=CC=C5)Cl)N=N1
InChI=1SC26H25ClN4O2Sc12347153426292523(303126)1911561220(19)2824(3325)22141321(3222)17981018(27)1617h56814162428H24715H21H3
MFCD02377668
ZINC000003772535
ZINC000003772536
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