Vitas-M small molecule compound
methyl 3-({4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}carbamoyl)-5-nitrobenzoate
Catalog ID
STK002059
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C
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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 C21H23N3O7S MW 461.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O7S/c1-14-7-9-23(10-8-14)32(29,30)19-5-3-17(4-6-19)22-20(25)15-11-16(21(26)31-2)13-18(12-15)24(27)28/h3-6,11-14H,7-10H2,1-2H3,(H,22,25)InChIKey
CTQWUJMIRDIDKI-UHFFFAOYSA-NSynonyms
590377-34-7590377347
CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C
InChI=1SC21H23N3O7Sc1147923(10814)32(2930)195317(4619)2220(25)151116(21(26)312)1318(1215)24(27)28h361114H710H212H3(H2225)
METHYL3((4((4METHYLPIPERIDIN1YL)SULFONYL)PHENYL)CARBAMOYL)5NITROBENZOATE
METHYL3((4(4METHYLPIPERIDIN1YL)SULFONYLPHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(4((4METHYLPIPERIDYL)SULFONYL)PHENYL)CARBAMOYL)3NITROBENZOATE
MFCD03715803
STK002059
ZINC000008916093
ZINC08916093
ZINC8916093
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