1-(2-bromophenyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-bromophenyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]triazole-4-carboxamide CAS Name: 1-(2-bromophenyl)-N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-4-triazolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]triazole-4-carboxamide Traditional Name: 1-(2-bromophenyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]triazole-4-carboxamide Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CN(N=N2)C3=CC=CC=C3Br)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CN(N=N2)C3=CC=CC=C3Br)OC

InChI

InChI=1S/C20H21BrN4O3/c1-4-28-18-10-9-14(11-19(18)27-3)13(2)22-20(26)16-12-25(24-23-16)17-8-6-5-7-15(17)21/h5-13H,4H2,1-3H3,(H,22,26)