2-bromanyl-5-methoxy-N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 2-bromanyl-5-methoxy-N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]benzamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]-2-bromo-5-methoxy-benzamide CAS Name: 2-bromo-5-methoxy-N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]-2-bromo-5-methoxybenzamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]-2-bromo-5-methoxy-benzamide Formula: C26H29BrN4O2 MolecularWeight: 509.43806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)NCC(C2=CN=CC=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)NCC(C2=CN=CC=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29BrN4O2/c1-33-22-9-10-24(27)23(16-22)26(32)29-18-25(21-8-5-11-28-17-21)31-14-12-30(13-15-31)19-20-6-3-2-4-7-20/h2-11,16-17,25H,12-15,18-19H2,1H3,(H,29,32)