5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-pyridylmethyl)benzamide CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazino]-N-(3-pyridylmethyl)benzamide Formula: C32H41N5O3 MolecularWeight: 543.69964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C32H41N5O3/c1-4-6-11-25(5-2)31(38)35-26-14-15-28(27(21-26)32(39)34-23-24-10-9-16-33-22-24)36-17-19-37(20-18-36)29-12-7-8-13-30(29)40-3/h7-10,12-16,21-22,25H,4-6,11,17-20,23H2,1-3H3,(H,34,39)(H,35,38)