Vitas-M small molecule compound
ethyl 5-ethyl-2-({[4-(4-ethylpiperazin-1-yl)-3-nitrophenyl]carbonyl}amino)thiophene-3-carboxylate
Catalog ID
STK763400
SMILES CCOC(=O)c1cc(sc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)CC)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 C22H28N4O5S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5S/c1-4-16-14-17(22(28)31-6-3)21(32-16)23-20(27)15-7-8-18(19(13-15)26(29)30)25-11-9-24(5-2)10-12-25/h7-8,13-14H,4-6,9-12H2,1-3H3,(H,23,27)InChIKey
MIBIEUGRFVNJRM-UHFFFAOYSA-NSynonyms
372978-05-7372978057
CCC1=CC(=C(S1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC)(N+)(=O)(O))C(=O)OCC
CCOC(=O)c1cc(sc1NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)CC)CC
ETHYL5ETHYL2(((4(4ETHYLPIPERAZIN1YL)3NITROPHENYL)CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5ETHYL2((4(4ETHYLPIPERAZIN1YL)3NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ethyl5ethyl2(4(4ethylpiperazin1yl)3nitrobenzamido)thiophene3carboxylate
InChI=1SC22H28N4O5Sc14161417(22(28)3163)21(3216)2320(27)157818(19(1315)26(29)30)2511924(52)101225h781314H46912H213H3(H2327)
MFCD01954130
ZINC000008817542
ZINC8817542
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