2-[1-(N-cyano-N'-phenethyl-carbamimidoyl)-4-phenyl-piperidin-4-yl]-N-(6-methoxycyclohexa-1,5-dien-1-yl)ethanamide

Systemtic Name: 2-[1-(N-cyano-N'-phenethyl-carbamimidoyl)-4-phenyl-piperidin-4-yl]-N-(6-methoxycyclohexa-1,5-dien-1-yl)ethanamide Openeye Name: 2-[1-(N-cyano-N'-phenethyl-carbamimidoyl)-4-phenyl-4-piperidyl]-N-(6-methoxycyclohexa-1,5-dien-1-yl)acetamide CAS Name: 2-[1-[(cyanoamino)-phenethyliminomethyl]-4-phenyl-4-piperidinyl]-N-(6-methoxy-1-cyclohexa-1,5-dienyl)acetamide IUPAC Name: 2-[1-(N-cyano-N'-phenethylcarbamimidoyl)-4-phenylpiperidin-4-yl]-N-(6-methoxycyclohexa-1,5-dien-1-yl)acetamide Traditional Name: 2-[1-(N-cyano-N'-phenethyl-amidino)-4-phenyl-4-piperidyl]-N-(6-methoxycyclohexa-1,5-dien-1-yl)acetamide Formula: C30H35N5O2 MolecularWeight: 497.6312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CCCC=C1NC(=O)CC2(CCN(CC2)C(=NCCC3=CC=CC=C3)NC#N)C4=CC=CC=C4

Isomeric SMILES

COC1=CCCC=C1NC(=O)CC2(CCN(CC2)C(=NCCC3=CC=CC=C3)NC#N)C4=CC=CC=C4

InChI

InChI=1S/C30H35N5O2/c1-37-27-15-9-8-14-26(27)34-28(36)22-30(25-12-6-3-7-13-25)17-20-35(21-18-30)29(33-23-31)32-19-16-24-10-4-2-5-11-24/h2-7,10-15H,8-9,16-22H2,1H3,(H,32,33)(H,34,36)