Vitas-M small molecule compound
N-(3-nitrophenyl)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Catalog ID
STK296395
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)[N+](=O)[O-]
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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 C27H16N4O7S MW 540.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H16N4O7S/c32-25(28-17-2-1-3-20(15-17)31(37)38)16-4-13-23-24(14-16)27(34)29(26(23)33)18-5-9-21(10-6-18)39-22-11-7-19(8-12-22)30(35)36/h1-15H,(H,28,32)InChIKey
PKRJDTVEXGIIIT-UHFFFAOYSA-NSynonyms
C1=CC(=CC(=C1)(N+)(=O)(O))NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)SC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC27H16N4O7Sc3225(281721320(1517)31(37)38)164132324(1416)27(34)29(26(23)33)185921(10618)392211719(81222)30(35)36h115H(H2832)
MFCD00307950
N(3nitrophenyl)2(4((4nitrophenyl)sulfanyl)phenyl)13dioxo23dihydro1Hisoindole5carboxamide
N(3NITROPHENYL)2(4(4NITROPHENYL)SULFANYLPHENYL)13DIOXOISOINDOLE5CARBOXAMIDE
O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Sc1ccc(cc1)(N+)(=O)(O))Nc1cccc(c1)(N+)(=O)(O)
ZINC000003143022
ZINC3143022
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