Vitas-M small molecule compound
4-chloro-N-(3-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-nitrobenzamide
Catalog ID
STK705363
SMILES Clc1cccc(c1)CN(C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)C1CCS(=O)(=O)C1
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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 C18H16Cl2N2O5S MW 443.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2N2O5S/c19-14-3-1-2-12(8-14)10-21(15-6-7-28(26,27)11-15)18(23)13-4-5-16(20)17(9-13)22(24)25/h1-5,8-9,15H,6-7,10-11H2InChIKey
QQBYRVNMFSFQIA-UHFFFAOYSA-NSynonyms
577762-10-84CHLORON((3CHLOROPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)3NITROBENZAMIDE
4chloroN(3chlorobenzyl)N(11dioxidotetrahydrothiophen3yl)3nitrobenzamide
4CHLORON(3CHLOROBENZYL)N(11DIOXOTETRAHYDRO1LAMBDA6THIOPHEN3YL)3NITROBENZAMIDE
577762108
C1CS(=O)(=O)CC1N(CC2=CC(=CC=C2)Cl)C(=O)C3=CC(=C(C=C3)Cl)(N+)(=O)(O)
Clc1cccc(c1)CN(C(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)C1CCS(=O)(=O)C1
InChI=1SC18H16Cl2N2O5Sc191431212(814)1021(156728(2627)1115)18(23)134516(20)17(913)22(24)25h158915H671011H2
MFCD04018557
ZINC000008691441
ZINC000009411251
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