Vitas-M small molecule compound
(3E)-3-benzylidene-2-(propan-2-yl)-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide
Catalog ID
STL441433
SMILES O=C1/C(=C\c2ccccc2)/N(C(C)C)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 C18H17NO3S MW 327.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO3S/c1-13(2)19-16(12-14-8-4-3-5-9-14)18(20)15-10-6-7-11-17(15)23(19,21)22/h3-13H,1-2H3/b16-12+InChIKey
ADCRLKRQMNZQIP-FOWTUZBSSA-NSynonyms
(3E)3benzylidene11dioxo2propan2yl1$l^(6)2benzothiazin4one
(3E)3benzylidene2(propan2yl)23dihydro4H12benzothiazin4one11dioxide
CC(C)N1C(=CC2=CC=CC=C2)C(=O)C3=CC=CC=C3S1(=O)=O
InChI=1SC18H17NO3Sc113(2)1916(12148435914)18(20)1510671117(15)23(1921)22h313H12H3b1612+
MFCD08060302
O=C1C(=Cc2ccccc2)N(C(C)C)S(=O)(=O)c2c1cccc2
ZINC000005274932
ZINC5274932
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