Vitas-M small molecule compound
2-({2-[(2,4-dimethyl-6-nitrophenyl)amino]-2-oxoethyl}sulfanyl)benzoic acid
Catalog ID
STK328644
SMILES O=C(Nc1c(C)cc(cc1[N+](=O)[O-])C)CSc1ccccc1C(=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 C17H16N2O5S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S/c1-10-7-11(2)16(13(8-10)19(23)24)18-15(20)9-25-14-6-4-3-5-12(14)17(21)22/h3-8H,9H2,1-2H3,(H,18,20)(H,21,22)InChIKey
MWBTYZULVDAKEZ-UHFFFAOYSA-NSynonyms
728035-26-52((2((24dimethyl6nitrophenyl)amino)2oxoethyl)sulfanyl)benzoicacid
2(2(24DIMETHYL6NITROANILINO)2OXOETHYL)SULFANYLBENZOICACID
728035265
CC1=CC(=C(C(=C1)(N+)(=O)(O))NC(=O)CSC2=CC=CC=C2C(=O)O)C
InChI=1SC17H16N2O5Sc110711(2)16(13(810)19(23)24)1815(20)92514643512(14)17(21)22h38H9H212H3(H1820)(H2122)
MFCD06017177
O=C(Nc1c(C)cc(cc1(N+)(=O)(O))C)CSc1ccccc1C(=O)O
ZINC000004727920
ZINC4727920
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