Vitas-M small molecule compound
methyl 3-{[4-(dibutylsulfamoyl)phenyl]carbamoyl}-5-nitrobenzoate
Catalog ID
STK158953
SMILES CCCCN(S(=O)(=O)c1ccc(cc1)NC(=O)c1cc(cc(c1)C(=O)OC)[N+](=O)[O-])CCCC
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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 C23H29N3O7S MW 491.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O7S/c1-4-6-12-25(13-7-5-2)34(31,32)21-10-8-19(9-11-21)24-22(27)17-14-18(23(28)33-3)16-20(15-17)26(29)30/h8-11,14-16H,4-7,12-13H2,1-3H3,(H,24,27)InChIKey
KHVHHMGEFLQVOS-UHFFFAOYSA-NSynonyms
600132-37-4600132374
CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
CCCCN(S(=O)(=O)c1ccc(cc1)NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O))CCCC
InChI=1SC23H29N3O7Sc1461225(13752)34(3132)2110819(91121)2422(27)171418(23(28)333)1620(1517)26(29)30h8111416H471213H213H3(H2427)
METHYL3((4(DIBUTYLSULFAMOYL)PHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(4((DIBUTYLAMINO)SULFONYL)PHENYL)CARBAMOYL)3NITROBENZOATE
MFCD03639901
ZINC000014008947
ZINC14008947
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