Vitas-M small molecule compound
[4-(4-butylphenyl)-1,1-dioxido-4H-1,4-benzothiazin-2-yl](3,4-dimethoxyphenyl)methanone
Catalog ID
STL095461
SMILES CCCCc1ccc(cc1)N1C=C(C(=O)c2ccc(c(c2)OC)OC)S(=O)(=O)c2c1cccc2
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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 C27H27NO5S MW 477.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO5S/c1-4-5-8-19-11-14-21(15-12-19)28-18-26(34(30,31)25-10-7-6-9-22(25)28)27(29)20-13-16-23(32-2)24(17-20)33-3/h6-7,9-18H,4-5,8H2,1-3H3InChIKey
SADMILRNQTWZTG-UHFFFAOYSA-NSynonyms
1114872-56-8(4(4butylphenyl)11dioxido4H14benzothiazin2yl)(34dimethoxyphenyl)methanone
(4(4BUTYLPHENYL)11DIOXIDO4HBENZO(B)(14)THIAZIN2YL)(34DIMETHOXYPHENYL)METHANONE
(4(4butylphenyl)11dioxo1$l^(6)4benzothiazin2yl)(34dimethoxyphenyl)methanone
1114872568
CCCCC1=CC=C(C=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C(=O)C4=CC(=C(C=C4)OC)OC
InChI=1SC27H27NO5Sc145819111421(151219)281826(34(3031)251076922(25)28)27(29)20131623(322)24(1720)333h67918H458H213H3
MFCD14953609
ZINC000032984475
ZINC32984475
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