N-[(E)-anthracen-9-ylmethylideneamino]-1-[(3-bromophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(E)-anthracen-9-ylmethylideneamino]-1-[(3-bromophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-9-anthrylmethyleneamino]-1-[(3-bromophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-9-anthracenylmethylideneamino]-1-[(3-bromophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-anthracen-9-ylmethylideneamino]-1-[(3-bromophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-9-anthrylmethyleneamino]-1-(3-bromobenzyl)pyrazole-3-carboxamide Formula: C26H19BrN4O MolecularWeight: 483.35926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=NNC(=O)C4=NN(C=C4)CC5=CC(=CC=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=N/NC(=O)C4=NN(C=C4)CC5=CC(=CC=C5)Br

InChI

InChI=1S/C26H19BrN4O/c27-21-9-5-6-18(14-21)17-31-13-12-25(30-31)26(32)29-28-16-24-22-10-3-1-7-19(22)15-20-8-2-4-11-23(20)24/h1-16H,17H2,(H,29,32)/b28-16+