4-[1-[3-(dimethylamino)propyl]piperidin-4-yl]oxy-N-[4-[2-methoxy-4-(pentan-3-ylcarbamoylamino)phenoxy]phenyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[1-[3-(dimethylamino)propyl]piperidin-4-yl]oxy-N-[4-[2-methoxy-4-(pentan-3-ylcarbamoylamino)phenoxy]phenyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[[1-[3-(dimethylamino)propyl]-4-piperidyl]oxy]-N-[4-[4-(1-ethylpropylcarbamoylamino)-2-methoxy-phenoxy]phenyl]-N-isobutyl-benzamide CAS Name: 4-[[1-[3-(dimethylamino)propyl]-4-piperidinyl]oxy]-N-[4-[2-methoxy-4-[[oxo-(pentan-3-ylamino)methyl]amino]phenoxy]phenyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[1-[3-(dimethylamino)propyl]piperidin-4-yl]oxy-N-[4-[2-methoxy-4-(pentan-3-ylcarbamoylamino)phenoxy]phenyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-[[1-[3-(dimethylamino)propyl]-4-piperidyl]oxy]-N-[4-[4-(1-ethylpropylcarbamoylamino)-2-methoxy-phenoxy]phenyl]-N-isobutyl-benzamide Formula: C40H57N5O5 MolecularWeight: 687.91108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NC1=CC(=C(C=C1)OC2=CC=C(C=C2)N(CC(C)C)C(=O)C3=CC=C(C=C3)OC4CCN(CC4)CCCN(C)C)OC

Isomeric SMILES

CCC(CC)NC(=O)NC1=CC(=C(C=C1)OC2=CC=C(C=C2)N(CC(C)C)C(=O)C3=CC=C(C=C3)OC4CCN(CC4)CCCN(C)C)OC

InChI

InChI=1S/C40H57N5O5/c1-8-31(9-2)41-40(47)42-32-13-20-37(38(27-32)48-7)50-35-18-14-33(15-19-35)45(28-29(3)4)39(46)30-11-16-34(17-12-30)49-36-21-25-44(26-22-36)24-10-23-43(5)6/h11-20,27,29,31,36H,8-10,21-26,28H2,1-7H3,(H2,41,42,47)