Vitas-M small molecule compound

N-(4-chloro-2-methylphenyl)-N-{2-[(2E)-2-(1,2-dihydroacenaphthylen-5-ylmethylidene)hydrazinyl]-2-oxoethyl}benzenesulfonamide (non-preferred name)

Catalog ID
STK358285
SMILES O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1C)Cl)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 C28H24ClN3O3S MW 518.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN3O3S/c1-19-16-23(29)14-15-26(19)32(36(34,35)24-7-3-2-4-8-24)18-27(33)31-30-17-22-13-12-21-11-10-20-6-5-9-25(22)28(20)21/h2-9,12-17H,10-11,18H2,1H3,(H,31,33)/b30-17+
InChIKey
ISYPIBVXEUYQLB-OCSSWDANSA-N
Synonyms

2(N(benzenesulfonyl)4chloro2methylanilino)N((E)12dihydroacenaphthylen5ylmethylideneamino)acetamide
CC1=C(C=CC(=C1)Cl)N(CC(=O)NN=CC2=C3C=CC=C4C3=C(CC4)C=C2)S(=O)(=O)C5=CC=CC=C5
InChI=1SC28H24ClN3O3Sc1191623(29)141526(19)32(36(3435)247324824)1827(33)3130172213122111102065925(22)28(20)21h291217H101118H21H3(H3133)b3017+
MFCD03550128
N((1E)2ACENAPHTHEN5YL1AZAVINYL)2((4CHLORO2METHYLPHENYL)(PHENYLSULFONYL)AMINO)ACETAMIDE
N(4CHLORO2METHYLPHENYL)N(2((2E)2(12DIHYDROACENAPHTHYLEN5YLMETHYLIDENE)HYDRAZINYL)2OXOETHYL)BENZENESULFONAMIDE(NONPREFERREDNAME)
O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1C)Cl)NN=Cc1ccc2c3c1cccc3CC2
ZINC000014166520
ZINC33708575

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.