Vitas-M small molecule compound
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-methyl-3-nitrobenzamide
Catalog ID
STK132943
SMILES O=C(c1cccc(c1C)[N+](=O)[O-])Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1
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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 C20H23N3O5S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5S/c1-15-18(7-6-8-19(15)23(25)26)20(24)21-16-9-11-17(12-10-16)29(27,28)22-13-4-2-3-5-14-22/h6-12H,2-5,13-14H2,1H3,(H,21,24)InChIKey
LUWOWHYDLMVKDF-UHFFFAOYSA-NSynonyms
701218-06-6701218066
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3
InChI=1SC20H23N3O5Sc11518(76819(15)23(25)26)20(24)211691117(121016)29(2728)221342351422h612H251314H21H3(H2124)
MFCD04218531
N(4(AZAPERHYDROEPINYLSULFONYL)PHENYL)(2METHYL3NITROPHENYL)CARBOXAMIDE
N(4(AZEPAN1YLSULFONYL)PHENYL)2METHYL3NITROBENZAMIDE
O=C(c1cccc(c1C)(N+)(=O)(O))Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1
ZINC000001112709
ZINC01112709
ZINC1112709
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