Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-nitro-N-[4-(propan-2-yl)benzyl]benzamide
Catalog ID
STK705961
SMILES CC(c1ccc(cc1)CN(C(=O)c1ccc(cc1)[N+](=O)[O-])C1CCS(=O)(=O)C1)C
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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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-15(2)17-5-3-16(4-6-17)13-22(20-11-12-29(27,28)14-20)21(24)18-7-9-19(10-8-18)23(25)26/h3-10,15,20H,11-14H2,1-2H3InChIKey
UZHVXNOFMCHUPQ-UHFFFAOYSA-NSynonyms
586995-72-4586995724
CC(C)C1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CC(c1ccc(cc1)CN(C(=O)c1ccc(cc1)(N+)(=O)(O))C1CCS(=O)(=O)C1)C
InChI=1SC21H24N2O5Sc115(2)175316(4617)1322(20111229(2728)1420)21(24)187919(10818)23(25)26h3101520H1114H212H3
MFCD04033064
N(11dioxidotetrahydrothiophen3yl)4nitroN(4(propan2yl)benzyl)benzamide
N(11dioxidotetrahydrothiophen3yl)N(4isopropylbenzyl)4nitrobenzamide
N(11DIOXOTHIOLAN3YL)4NITRON((4PROPAN2YLPHENYL)METHYL)BENZAMIDE
ZINC000005119783
ZINC000005119784
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