Vitas-M small molecule compound
(3E)-2-(3-phenylpropyl)-3-(pyridin-3-ylmethylidene)-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide
Catalog ID
STL234181
SMILES O=C1/C(=C\c2cccnc2)/N(CCCc2ccccc2)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 C23H20N2O3S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O3S/c26-23-20-12-4-5-13-22(20)29(27,28)25(15-7-11-18-8-2-1-3-9-18)21(23)16-19-10-6-14-24-17-19/h1-6,8-10,12-14,16-17H,7,11,15H2/b21-16+InChIKey
PCAUHLINFHTSSH-LTGZKZEYSA-NSynonyms
951954-87-3(3E)11dioxo2(3phenylpropyl)3(pyridin3ylmethylidene)1$l^(6)2benzothiazin4one
(3E)2(3phenylpropyl)3(pyridin3ylmethylidene)23dihydro4H12benzothiazin4one11dioxide
(E)2(3phenylpropyl)3(pyridin3ylmethylene)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
951954873
C1=CC=C(C=C1)CCCN2C(=CC3=CN=CC=C3)C(=O)C4=CC=CC=C4S2(=O)=O
InChI=1SC23H20N2O3Sc26232012451322(20)29(2728)25(15711188213918)21(23)161910614241719h1681012141617H71115H2b2116+
MFCD09857728
O=C1C(=Cc2cccnc2)N(CCCc2ccccc2)S(=O)(=O)c2c1cccc2
ZINC000013731360
ZINC13731360
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