Vitas-M small molecule compound

naphthalen-1-yl{4-(4-nitrophenyl)-2-[(2,4,6-trimethylbenzyl)sulfanyl]-1H-imidazol-1-yl}methanone

Catalog ID
STK547043
SMILES Cc1cc(C)c(c(c1)C)CSc1nc(cn1C(=O)c1cccc2c1cccc2)c1ccc(cc1)[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 C30H25N3O3S MW 507.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O3S/c1-19-15-20(2)27(21(3)16-19)18-37-30-31-28(23-11-13-24(14-12-23)33(35)36)17-32(30)29(34)26-10-6-8-22-7-4-5-9-25(22)26/h4-17H,18H2,1-3H3
InChIKey
DLZWDJGYBGTDMX-UHFFFAOYSA-N
Synonyms
384858-02-0
384858020
CC1=CC(=C(C(=C1)C)CSC2=NC(=CN2C(=O)C3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)(N+)(=O)(O))C
Cc1cc(C)c(c(c1)C)CSc1nc(cn1C(=O)c1cccc2c1cccc2)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC30H25N3O3Sc1191520(2)27(21(3)1619)1837303128(23111324(141223)33(35)36)1732(30)29(34)26106822745925(22)26h417H18H213H3
MFCD02648670
naphthalen1yl(4(4nitrophenyl)2((246trimethylbenzyl)sulfanyl)1Himidazol1yl)methanone
naphthalen1yl(4(4nitrophenyl)2((246trimethylbenzyl)thio)1Himidazol1yl)methanone
NAPHTHALEN1YL(4(4NITROPHENYL)2((246TRIMETHYLPHENYL)METHYLSULFANYL)IMIDAZOL1YL)METHANONE
ZINC000002370019
ZINC02370019
ZINC2370019

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Available files

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