(4-bromophenyl)-[4-[6-[(phenylmethyl)amino]pyridazin-3-yl]piperazin-1-yl]methanone

Systemtic Name: (4-bromophenyl)-[4-[6-[(phenylmethyl)amino]pyridazin-3-yl]piperazin-1-yl]methanone Openeye Name: [4-[6-(benzylamino)pyridazin-3-yl]piperazin-1-yl]-(4-bromophenyl)methanone CAS Name: (4-bromophenyl)-[4-[6-[(phenylmethyl)amino]-3-pyridazinyl]-1-piperazinyl]methanone IUPAC Name: [4-[6-(benzylamino)pyridazin-3-yl]piperazin-1-yl]-(4-bromophenyl)methanone Traditional Name: [4-[6-(benzylamino)pyridazin-3-yl]piperazino]-(4-bromophenyl)methanone Formula: C22H22BrN5O MolecularWeight: 452.34698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)NCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)NCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H22BrN5O/c23-19-8-6-18(7-9-19)22(29)28-14-12-27(13-15-28)21-11-10-20(25-26-21)24-16-17-4-2-1-3-5-17/h1-11H,12-16H2,(H,24,25)