Vitas-M small molecule compound
N-{2-[(2E)-2-(1,2-dihydroacenaphthylen-5-ylmethylidene)hydrazinyl]-2-oxoethyl}-N-(4-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide (non-preferred name)
Catalog ID
STK131887
SMILES O=C(CN(S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(cc1)F)N/N=C/c1ccc2c3c1cccc3CC2
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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 C29H24FN3O5S MW 545.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24FN3O5S/c30-22-8-10-23(11-9-22)33(39(35,36)24-12-13-26-27(16-24)38-15-14-37-26)18-28(34)32-31-17-21-7-6-20-5-4-19-2-1-3-25(21)29(19)20/h1-3,6-13,16-17H,4-5,14-15,18H2,(H,32,34)/b31-17+InChIKey
UPGDMQAPDQQYCI-KBVAKVRCSA-NSynonyms
C1CC2=CC=CC3=C(C=CC1=C23)C=NNC(=O)CN(C4=CC=C(C=C4)F)S(=O)(=O)C5=CC6=C(C=C5)OCCO6
InChI=1SC29H24FN3O5Sc302281023(11922)33(39(3536)2412132627(1624)3815143726)1828(34)323117217620541921325(21)29(19)20h136131617H45141518H2(H3234)b3117+
MFCD06124617
N((E)12dihydroacenaphthylen5ylmethylideneamino)2(N(23dihydro14benzodioxin6ylsulfonyl)4fluoroanilino)acetamide
N(2((2E)2(12DIHYDROACENAPHTHYLEN5YLMETHYLIDENE)HYDRAZINYL)2OXOETHYL)N(4FLUOROPHENYL)23DIHYDRO14BENZODIOXINE6SULFONAMIDE(NONPREFERREDNAME)
O=C(CN(S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(cc1)F)NN=Cc1ccc2c3c1cccc3CC2
ZINC000059652247
ZINC101579786
Check stock
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Check stock on Vitas-MAvailable files
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