Vitas-M small molecule compound
N-[3-(diethylamino)-2-hydroxypropyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide
Catalog ID
STL057481
SMILES CCN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-])O)CC
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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 C20H27N3O5S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O5S/c1-4-21(5-2)14-19(24)15-22(17-7-6-8-18(13-17)23(25)26)29(27,28)20-11-9-16(3)10-12-20/h6-13,19,24H,4-5,14-15H2,1-3H3InChIKey
IURCDXBVRVEDOC-UHFFFAOYSA-NSynonyms
CCN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)(N+)(=O)(O))O)CC
CCN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)(N+)(=O)(O))O)CCCl
CCN(CC)CC(CN(C1=CC(=CC=C1)(N+)(=O)(O))S(=O)(=O)C2=CC=C(C=C2)C)O
InChI=1SC20H27N3O5Sc1421(52)1419(24)1522(1776818(1317)23(25)26)29(2728)2011916(3)101220h6131924H451415H213H3
MFCD03671264
N((2R)3(DIETHYLAMINO)2HYDROXYPROPYL)4METHYLN(3NITROPHENYL)BENZENESULFONAMIDE
N(3(diethylamino)2hydroxypropyl)4methylN(3nitrophenyl)benzenesulfonamide
N(3(diethylamino)2hydroxypropyl)4methylN(3nitrophenyl)benzenesulfonamidehydrochloride
ZINC000001900870
ZINC000001900871
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