Vitas-M small molecule compound
N-[(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)carbamothioyl]-3-nitro-4-(piperidin-1-yl)benzamide
Catalog ID
STK355582
SMILES S=C(NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)Nc1ccc2c(c1)C(=O)N(C2=O)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 C22H21N5O5S MW 467.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O5S/c1-25-20(29)15-7-6-14(12-16(15)21(25)30)23-22(33)24-19(28)13-5-8-17(18(11-13)27(31)32)26-9-3-2-4-10-26/h5-8,11-12H,2-4,9-10H2,1H3,(H2,23,24,28,33)InChIKey
KUCBIVOPLXRUJS-UHFFFAOYSA-NSynonyms
CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)(N+)(=O)(O)
InChI=1SC22H21N5O5Sc12520(29)157614(1216(15)21(25)30)2322(33)2419(28)135817(18(1113)27(31)32)2693241026h581112H24910H21H3(H223242833)
MFCD06007458
N((2methyl13dioxo23dihydro1Hisoindol5yl)carbamothioyl)3nitro4(piperidin1yl)benzamide
N((2METHYL13DIOXOISOINDOL5YL)CARBAMOTHIOYL)3NITRO4PIPERIDIN1YLBENZAMIDE
S=C(NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCCC1)Nc1ccc2c(c1)C(=O)N(C2=O)C
ZINC000016188989
ZINC16188989
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