Vitas-M small molecule compound
N-[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]-5-nitrofuran-2-carboxamide
Catalog ID
STK133354
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=O)c1ccc(o1)[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 C21H18ClN5O4 MW 439.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O4/c1-2-3-4-13-5-7-14(8-6-13)26-24-17-11-15(22)16(12-18(17)25-26)23-21(28)19-9-10-20(31-19)27(29)30/h5-12H,2-4H2,1H3,(H,23,28)InChIKey
CAWMCWUSBOFGSQ-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC=C(O4)(N+)(=O)(O)
CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=O)c1ccc(o1)(N+)(=O)(O)
InChI=1SC21H18ClN5O4c1234135714(8613)2624171115(22)16(1218(17)2526)2321(28)1991020(3119)27(29)30h512H24H21H3(H2328)
MFCD03907618
N(2(4BUTYLPHENYL)6CHLORO2HBENZOTRIAZOL5YL)5NITROFURAN2CARBOXAMIDE
N(2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)5NITROFURAN2CARBOXAMIDE
ZINC000002842078
ZINC02842078
ZINC2842078
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