6-[(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-phenethyl-benzotriazole

Systemtic Name: 6-[(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-phenethyl-benzotriazole Openeye Name: 6-[(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-phenethyl-benzotriazole CAS Name: 6-[(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-phenethylbenzotriazole IUPAC Name: 6-[(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-phenethylbenzotriazole Traditional Name: 6-[(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-phenethyl-benzotriazole Formula: C23H19ClN6 MolecularWeight: 414.89016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C=CC(=C3)C(C4=CC=C(C=C4)Cl)N5C=NC=N5)N=N2

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C=CC(=C3)C(C4=CC=C(C=C4)Cl)N5C=NC=N5)N=N2

InChI

InChI=1S/C23H19ClN6/c24-20-9-6-18(7-10-20)23(30-16-25-15-26-30)19-8-11-21-22(14-19)29(28-27-21)13-12-17-4-2-1-3-5-17/h1-11,14-16,23H,12-13H2