Vitas-M small molecule compound
1-{3,5-bis[(3-chlorobenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-phenylpropan-1-one
Catalog ID
STK169809
SMILES Clc1cccc(c1)CNc1nc(nn1C(=O)CCc1ccccc1)NCc1cccc(c1)Cl
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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 C25H23Cl2N5O MW 480.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23Cl2N5O/c26-21-10-4-8-19(14-21)16-28-24-30-25(29-17-20-9-5-11-22(27)15-20)32(31-24)23(33)13-12-18-6-2-1-3-7-18/h1-11,14-15H,12-13,16-17H2,(H2,28,29,30,31)InChIKey
OCBPCKMQJQZWAP-UHFFFAOYSA-NSynonyms
1(35BIS((3CHLOROBENZYL)AMINO)1H124TRIAZOL1YL)3PHENYLPROPAN1ONE
1(35bis((3chlorophenyl)methylamino)124triazol1yl)3phenylpropan1one
C1=CC=C(C=C1)CCC(=O)N2C(=NC(=N2)NCC3=CC(=CC=C3)Cl)NCC4=CC(=CC=C4)Cl
InChI=1SC25H23Cl2N5Oc2621104819(1421)1628243025(291720951122(27)1520)32(3124)23(33)1312186213718h1111415H12131617H2(H228293031)
MFCD06663342
ZINC000009847089
ZINC09847089
ZINC9847089
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