Vitas-M small molecule compound
methyl 3-{[4-(cyclohexylsulfamoyl)phenyl]carbamoyl}-5-nitrobenzoate
Catalog ID
STK204323
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ccc(cc1)S(=O)(=O)NC1CCCCC1
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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/c1-31-21(26)15-11-14(12-18(13-15)24(27)28)20(25)22-16-7-9-19(10-8-16)32(29,30)23-17-5-3-2-4-6-17/h7-13,17,23H,2-6H2,1H3,(H,22,25)InChIKey
AKPVAUOCQUCUFH-UHFFFAOYSA-NSynonyms
827617-54-9827617549
COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1ccc(cc1)S(=O)(=O)NC1CCCCC1
InChI=1SC21H23N3O7Sc13121(26)151114(1218(1315)24(27)28)20(25)22167919(10816)32(2930)23175324617h7131723H26H21H3(H2225)
METHYL3((4(CYCLOHEXYLSULFAMOYL)PHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(4((CYCLOHEXYLAMINO)SULFONYL)PHENYL)CARBAMOYL)3NITROBENZOATE
MFCD06153164
ZINC000002873917
ZINC02873917
ZINC2873917
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