Vitas-M small molecule compound
1,4-bis{[2,5-dimethoxy-4-(1H-tetrazol-1-yl)phenyl]sulfonyl}-1,4-diazepane
Catalog ID
STK665285
SMILES COc1cc(c(cc1S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1cc(OC)c(cc1OC)n1cnnn1)OC)n1cnnn1
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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 C23H28N10O8S2 MW 636.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N10O8S2/c1-38-18-12-22(20(40-3)10-16(18)32-14-24-26-28-32)42(34,35)30-6-5-7-31(9-8-30)43(36,37)23-13-19(39-2)17(11-21(23)41-4)33-15-25-27-29-33/h10-15H,5-9H2,1-4H3InChIKey
VWBJEXAKMODMCP-UHFFFAOYSA-NSynonyms
14bis((25dimethoxy4(1Htetrazol1yl)phenyl)sulfonyl)14diazepane
14bis((25dimethoxy4(tetrazol1yl)phenyl)sulfonyl)14diazepane
COC1=CC(=C(C=C1N2C=NN=N2)OC)S(=O)(=O)N3CCCN(CC3)S(=O)(=O)C4=C(C=C(C(=C4)OC)N5C=NN=N5)OC
InChI=1SC23H28N10O8S2c138181222(20(403)1016(18)321424262832)42(3435)3065731(9830)43(3637)231319(392)17(1121(23)414)331525272933h1015H59H214H3
MFCD08142745
ZINC000098048352
ZINC98048352
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