N-(4-bromophenyl)-2-[5-methoxy-4-oxidanylidene-2-[(4-phenylpiperazin-1-yl)methyl]pyridin-1-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxidanylidene-2-[(4-phenylpiperazin-1-yl)methyl]pyridin-1-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxo-2-[(4-phenylpiperazin-1-yl)methyl]-1-pyridyl]acetamide CAS Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxo-2-[(4-phenyl-1-piperazinyl)methyl]-1-pyridinyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxo-2-[(4-phenylpiperazin-1-yl)methyl]pyridin-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-keto-5-methoxy-2-[(4-phenylpiperazino)methyl]-1-pyridyl]acetamide Formula: C25H27BrN4O3 MolecularWeight: 511.41088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)CN2CCN(CC2)C3=CC=CC=C3)CC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CN(C(=CC1=O)CN2CCN(CC2)C3=CC=CC=C3)CC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C25H27BrN4O3/c1-33-24-17-30(18-25(32)27-20-9-7-19(26)8-10-20)22(15-23(24)31)16-28-11-13-29(14-12-28)21-5-3-2-4-6-21/h2-10,15,17H,11-14,16,18H2,1H3,(H,27,32)