3-azanyl-N-(4-azanylcyclohexyl)-4-[4-[2-(4-methoxyphenyl)ethanoyl]piperazin-1-yl]benzamide

Systemtic Name: 3-azanyl-N-(4-azanylcyclohexyl)-4-[4-[2-(4-methoxyphenyl)ethanoyl]piperazin-1-yl]benzamide Openeye Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]benzamide CAS Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-[2-(4-methoxyphenyl)-1-oxoethyl]-1-piperazinyl]benzamide IUPAC Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]benzamide Traditional Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-[2-(4-methoxyphenyl)acetyl]piperazino]benzamide Formula: C26H35N5O3 MolecularWeight: 465.5878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)N

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)N

InChI

InChI=1S/C26H35N5O3/c1-34-22-9-2-18(3-10-22)16-25(32)31-14-12-30(13-15-31)24-11-4-19(17-23(24)28)26(33)29-21-7-5-20(27)6-8-21/h2-4,9-11,17,20-21H,5-8,12-16,27-28H2,1H3,(H,29,33)