Vitas-M small molecule compound
N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-(3-nitrophenyl)furan-2-carboxamide
Catalog ID
STK498359
SMILES CCCC(=O)Nc1nc2c(s1)cc(cc2)NC(=O)c1ccc(o1)c1cccc(c1)[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 C22H18N4O5S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O5S/c1-2-4-20(27)25-22-24-16-8-7-14(12-19(16)32-22)23-21(28)18-10-9-17(31-18)13-5-3-6-15(11-13)26(29)30/h3,5-12H,2,4H2,1H3,(H,23,28)(H,24,25,27)InChIKey
IAYLKCAYHNAQGC-UHFFFAOYSA-NSynonyms
CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O)
CCCC(=O)Nc1nc2c(s1)cc(cc2)NC(=O)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H18N4O5Sc12420(27)252224168714(1219(16)3222)2321(28)1810917(3118)1353615(1113)26(29)30h3512H24H21H3(H2328)(H242527)
MFCD09592257
N(2(butanoylamino)13benzothiazol6yl)5(3nitrophenyl)furan2carboxamide
ZINC000022529485
ZINC22529485
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