Vitas-M small molecule compound
methyl 3-({N-(4-methoxyphenyl)-N-[(4-methyl-3-nitrophenyl)sulfonyl]glycyl}amino)-4-methylbenzoate
Catalog ID
STL259144
SMILES COc1ccc(cc1)N(S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C)CC(=O)Nc1cc(ccc1C)C(=O)OC
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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 C25H25N3O8S MW 527.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O8S/c1-16-5-7-18(25(30)36-4)13-22(16)26-24(29)15-27(19-8-10-20(35-3)11-9-19)37(33,34)21-12-6-17(2)23(14-21)28(31)32/h5-14H,15H2,1-4H3,(H,26,29)InChIKey
RBPKCVYOSFGFRJ-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC(=C(C=C3)C)(N+)(=O)(O)
COc1ccc(cc1)N(S(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C)CC(=O)Nc1cc(ccc1C)C(=O)OC
InChI=1SC25H25N3O8Sc1165718(25(30)364)1322(16)2624(29)1527(1981020(353)11919)37(3334)2112617(2)23(1421)28(31)32h514H15H214H3(H2629)
METHYL3((2(4METHOXYN(4METHYL3NITROPHENYL)SULFONYLANILINO)ACETYL)AMINO)4METHYLBENZOATE
methyl3((N(4methoxyphenyl)N((4methyl3nitrophenyl)sulfonyl)glycyl)amino)4methylbenzoate
MFCD03232149
ZINC000059646480
ZINC59646480
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