Vitas-M small molecule compound
N-[3-(morpholin-4-ylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-nitrobenzamide
Catalog ID
STK427149
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1sc2c(c1C(=O)N1CCOCC1)CCCC2
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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 C20H21N3O5S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S/c24-18(13-5-7-14(8-6-13)23(26)27)21-19-17(15-3-1-2-4-16(15)29-19)20(25)22-9-11-28-12-10-22/h5-8H,1-4,9-12H2,(H,21,24)InChIKey
BQPVMIAGZNDZSS-UHFFFAOYSA-NSynonyms
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)N4CCOCC4
InChI=1SC20H21N3O5Sc2418(135714(8613)23(26)27)211917(15312416(15)2919)20(25)2291128121022h58H14912H2(H2124)
MFCD00782128
N(3(morpholin4ylcarbonyl)4567tetrahydro1benzothiophen2yl)4nitrobenzamide
N(3(morpholine4carbonyl)4567tetrahydro1benzothiophen2yl)4nitrobenzamide
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1sc2c(c1C(=O)N1CCOCC1)CCCC2
ZINC000002755889
ZINC02755889
ZINC2755889
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