1-[2-(3-chloranylphenoxy)ethyl]-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-[2-(3-chloranylphenoxy)ethyl]-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-[2-(3-chlorophenoxy)ethyl]-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-[2-(3-chlorophenoxy)ethyl]-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea IUPAC Name: 1-[2-(3-chlorophenoxy)ethyl]-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-[2-(3-chlorophenoxy)ethyl]-1-methyl-3-[4-(1,2,4-triazol-1-ylmethyl)benzyl]urea Formula: C20H22ClN5O2 MolecularWeight: 399.87398

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC(=CC=C1)Cl)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CN(CCOC1=CC(=CC=C1)Cl)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C20H22ClN5O2/c1-25(9-10-28-19-4-2-3-18(21)11-19)20(27)23-12-16-5-7-17(8-6-16)13-26-15-22-14-24-26/h2-8,11,14-15H,9-10,12-13H2,1H3,(H,23,27)