Vitas-M small molecule compound
3-{[(4-nitrophenyl)carbonyl]amino}phenyl 4-bromo-3-(piperidin-1-ylsulfonyl)benzoate
Catalog ID
STK750759
SMILES O=C(c1ccc(c(c1)S(=O)(=O)N1CCCCC1)Br)Oc1cccc(c1)NC(=O)c1ccc(cc1)[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 C25H22BrN3O7S MW 588.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN3O7S/c26-22-12-9-18(15-23(22)37(34,35)28-13-2-1-3-14-28)25(31)36-21-6-4-5-19(16-21)27-24(30)17-7-10-20(11-8-17)29(32)33/h4-12,15-16H,1-3,13-14H2,(H,27,30)InChIKey
ILTAOUJPLWSBMR-UHFFFAOYSA-NSynonyms
(3((4NITROBENZOYL)AMINO)PHENYL)4BROMO3PIPERIDIN1YLSULFONYLBENZOATE
3(((4NITROPHENYL)CARBONYL)AMINO)PHENYL4BROMO3(PIPERIDIN1YLSULFONYL)BENZOATE
C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC(=C3)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O))Br
InChI=1SC25H22BrN3O7Sc262212918(1523(22)37(3435)28132131428)25(31)362164519(1621)2724(30)1771020(11817)29(32)33h4121516H131314H2(H2730)
MFCD00745883
O=C(c1ccc(c(c1)S(=O)(=O)N1CCCCC1)Br)Oc1cccc(c1)NC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000000826769
ZINC00826769
ZINC826769
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