Vitas-M small molecule compound
1-(4-methoxyphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxamide
Catalog ID
STK265890
SMILES COc1ccc(cc1)N1CC(CC1=O)C(=O)Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]
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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 C19H16N4O5S MW 412.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O5S/c1-28-14-5-2-12(3-6-14)22-10-11(8-17(22)24)18(25)21-19-20-15-7-4-13(23(26)27)9-16(15)29-19/h2-7,9,11H,8,10H2,1H3,(H,20,21,25)InChIKey
WWGUGWJAKKFEOI-UHFFFAOYSA-NSynonyms
1(4methoxyphenyl)N(6nitro13benzothiazol2yl)5oxopyrrolidine3carboxamide
COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)N1CC(CC1=O)C(=O)Nc1nc2c(s1)cc(cc2)(N+)(=O)(O)
InChI=1SC19H16N4O5Sc128145212(3614)221011(817(22)24)18(25)211920157413(23(26)27)916(15)2919h27911H810H21H3(H202125)
MFCD06758867
ZINC000008473848
ZINC000008473854
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