Vitas-M small molecule compound
2-[4-(morpholin-4-yl)-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-2-yl]-1-(4-nitrophenyl)ethanone
Catalog ID
STK725063
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])CN1C(=C(N2CCOCC2)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1
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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 C27H23N3O7S MW 533.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O7S/c31-23(19-10-12-21(13-11-19)30(33)34)18-29-26(27(32)20-6-2-1-3-7-20)25(28-14-16-37-17-15-28)22-8-4-5-9-24(22)38(29,35)36/h1-13H,14-18H2InChIKey
HVIGGFNBEFAOTG-UHFFFAOYSA-NSynonyms
380651-18-32(3BENZOYL4MORPHOLIN4YL11DIOXIDO2H12BENZOTHIAZIN2YL)1(4NITROPHENYL)ETHANONE
2(3benzoyl4morpholin4yl11dioxo1$l^(6)2benzothiazin2yl)1(4nitrophenyl)ethanone
2(3benzoyl4morpholino11dioxido2Hbenzo(e)(12)thiazin2yl)1(4nitrophenyl)ethanone
2(4(morpholin4yl)11dioxido3(phenylcarbonyl)2H12benzothiazin2yl)1(4nitrophenyl)ethanone
380651183
C1COCCN1C2=C(N(S(=O)(=O)C3=CC=CC=C32)CC(=O)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C5=CC=CC=C5
InChI=1SC27H23N3O7Sc3123(19101221(131119)30(33)34)182926(27(32)206213720)25(28141637171528)22845924(22)38(2935)36h113H1418H2
MFCD02233677
O=C(c1ccc(cc1)(N+)(=O)(O))CN1C(=C(N2CCOCC2)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1
ZINC000000716099
ZINC00716099
ZINC716099
Check stock
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Check stock on Vitas-MAvailable files
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