4-(3-bromanylphenoxy)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]butanamide

Systemtic Name: 4-(3-bromanylphenoxy)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]butanamide Openeye Name: 4-(3-bromophenoxy)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]butanamide CAS Name: 4-(3-bromophenoxy)-N-[(1-methyl-2-imidazolyl)-phenylmethyl]butanamide IUPAC Name: 4-(3-bromophenoxy)-N-[(1-methylimidazol-2-yl)-phenylmethyl]butanamide Traditional Name: 4-(3-bromophenoxy)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]butyramide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H22BrN3O2/c1-25-13-12-23-21(25)20(16-7-3-2-4-8-16)24-19(26)11-6-14-27-18-10-5-9-17(22)15-18/h2-5,7-10,12-13,15,20H,6,11,14H2,1H3,(H,24,26)