N-(2-bromophenyl)-4-[1-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazine-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-[1-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazine-1-carboxamide Openeye Name: N-(2-bromophenyl)-4-[1-(3,4-dimethylphenyl)-6-oxo-pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(2-bromophenyl)-4-[1-(3,4-dimethylphenyl)-6-oxo-3-pyridazinyl]-1-piperazinecarboxamide IUPAC Name: N-(2-bromophenyl)-4-[1-(3,4-dimethylphenyl)-6-oxopyridazin-3-yl]piperazine-1-carboxamide Traditional Name: N-(2-bromophenyl)-4-[1-(3,4-dimethylphenyl)-6-keto-pyridazin-3-yl]piperazine-1-carboxamide Formula: C23H24BrN5O2 MolecularWeight: 482.37296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4Br)C

InChI

InChI=1S/C23H24BrN5O2/c1-16-7-8-18(15-17(16)2)29-22(30)10-9-21(26-29)27-11-13-28(14-12-27)23(31)25-20-6-4-3-5-19(20)24/h3-10,15H,11-14H2,1-2H3,(H,25,31)