Vitas-M small molecule compound
1-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-5-methyl-N-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL016509
SMILES Clc1ccc(cc1)c1onc2c1cc(cc2)n1nnc(c1C)C(=O)Nc1ccc(cc1)C(C)C
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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 C26H22ClN5O2 MW 471.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O2/c1-15(2)17-6-10-20(11-7-17)28-26(33)24-16(3)32(31-29-24)21-12-13-23-22(14-21)25(34-30-23)18-4-8-19(27)9-5-18/h4-15H,1-3H3,(H,28,33)InChIKey
JGSSUBWGFPKZBC-UHFFFAOYSA-NSynonyms
(1(3(4CHLOROPHENYL)BENZO(C)ISOXAZOL5YL)5METHYL(123TRIAZOL4YL))N(4(METHYLETHYL)PHENYL)CARBOXAMIDE
1(3(4chlorophenyl)21benzoxazol5yl)5methylN(4(propan2yl)phenyl)1H123triazole4carboxamide
1(3(4chlorophenyl)21benzoxazol5yl)5methylN(4propan2ylphenyl)triazole4carboxamide
CC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=C(C=C4)Cl)C(=O)NC5=CC=C(C=C5)C(C)C
InChI=1SC26H22ClN5O2c115(2)1761020(11717)2826(33)2416(3)32(312924)2112132322(1421)25(343023)184819(27)9518h415H13H3(H2833)
MFCD12968026
ZINC000015671393
ZINC15671393
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