3-[(4-fluorophenyl)methylcarbamoylamino]-N-[(2-methoxyphenyl)methyl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[(4-fluorophenyl)methylcarbamoylamino]-N-[(2-methoxyphenyl)methyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[(4-fluorophenyl)methylcarbamoylamino]-N-[(2-methoxyphenyl)methyl]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[(2-methoxyphenyl)methyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[(4-fluorophenyl)methylcarbamoylamino]-N-[(2-methoxyphenyl)methyl]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[(4-fluorobenzyl)carbamoylamino]-N-o-anisyl-4-pyrrolidino-benzamide Formula: C27H29FN4O3 MolecularWeight: 476.542563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C27H29FN4O3/c1-35-25-7-3-2-6-21(25)18-29-26(33)20-10-13-24(32-14-4-5-15-32)23(16-20)31-27(34)30-17-19-8-11-22(28)12-9-19/h2-3,6-13,16H,4-5,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)