Vitas-M small molecule compound

N-{2-[(2-chloro-6-fluorobenzyl)sulfanyl]ethyl}-N~2~-(methylsulfonyl)-N~2~-(3-nitrophenyl)glycinamide

Catalog ID
STL061319
SMILES O=C(CN(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-])NCCSCc1c(F)cccc1Cl

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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 C18H19ClFN3O5S2 MW 475.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClFN3O5S2/c1-30(27,28)22(13-4-2-5-14(10-13)23(25)26)11-18(24)21-8-9-29-12-15-16(19)6-3-7-17(15)20/h2-7,10H,8-9,11-12H2,1H3,(H,21,24)
InChIKey
BBBCYIDMOGOWDI-UHFFFAOYSA-N
Synonyms

CS(=O)(=O)N(CC(=O)NCCSCC1=C(C=CC=C1Cl)F)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC18H19ClFN3O5S2c130(2728)22(1342514(1013)23(25)26)1118(24)218929121516(19)63717(15)20h2710H891112H21H3(H2124)
MFCD03253383
N(2((2chloro6fluorobenzyl)sulfanyl)ethyl)N~2~(methylsulfonyl)N~2~(3nitrophenyl)glycinamide
N(2((2CHLORO6FLUOROBENZYL)SULFANYL)ETHYL)N2(METHYLSULFONYL)N2(3NITROPHENYL)GLYCINAMIDE
N(2((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)ETHYL)2(NMETHYLSULFONYL3NITROANILINO)ACETAMIDE
N1(2((2CHLORO6FLUOROBENZYL)THIO)ETHYL)N2(METHYLSULFONYL)N2(3NITROPHENYL)GLYCINAMIDE
O=C(CN(S(=O)(=O)C)c1cccc(c1)(N+)(=O)(O))NCCSCc1c(F)cccc1Cl
ZINC000002816716
ZINC02816716
ZINC2816716

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Available files

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