Vitas-M small molecule compound
methyl 2-(2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethyl)-4-phenyl-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide
Catalog ID
STL104919
SMILES COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1CC(=O)Nc1ccc(cc1)C(C)C
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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 C27H26N2O5S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5S/c1-18(2)19-13-15-21(16-14-19)28-24(30)17-29-26(27(31)34-3)25(20-9-5-4-6-10-20)22-11-7-8-12-23(22)35(29,32)33/h4-16,18H,17H2,1-3H3,(H,28,30)InChIKey
MTCQDNBKRIQAHH-UHFFFAOYSA-NSynonyms
1114878-99-71114878997
CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=C(C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4)C(=O)OC
InChI=1SC27H26N2O5Sc118(2)19131521(161419)2824(30)172926(27(31)343)25(2095461020)2211781223(22)35(2932)33h41618H17H213H3(H2830)
methyl11dioxo2(2oxo2(4propan2ylanilino)ethyl)4phenyl1$l^(6)2benzothiazine3carboxylate
METHYL2(2((4ISOPROPYLPHENYL)AMINO)2OXOETHYL)4PHENYL2HBENZO(E)(12)THIAZINE3CARBOXYLATE11DIOXIDE
methyl2(2oxo2((4(propan2yl)phenyl)amino)ethyl)4phenyl2H12benzothiazine3carboxylate11dioxide
MFCD14954148
ZINC000032984905
ZINC32984905
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