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

Systemtic Name: N-[(3-fluorophenyl)methyl]-3-[(4-methylphenyl)methylcarbamoylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(3-fluorophenyl)methyl]-3-(p-tolylmethylcarbamoylamino)-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(3-fluorophenyl)methyl]-3-[[[(4-methylphenyl)methylamino]-oxomethyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(3-fluorophenyl)methyl]-3-[(4-methylphenyl)methylcarbamoylamino]-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-fluorobenzyl)-3-[(4-methylbenzyl)carbamoylamino]-4-pyrrolidino-benzamide Formula: C27H29FN4O2 MolecularWeight: 460.543163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC(=CC=C3)F)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC(=CC=C3)F)N4CCCC4

InChI

InChI=1S/C27H29FN4O2/c1-19-7-9-20(10-8-19)17-30-27(34)31-24-16-22(11-12-25(24)32-13-2-3-14-32)26(33)29-18-21-5-4-6-23(28)15-21/h4-12,15-16H,2-3,13-14,17-18H2,1H3,(H,29,33)(H2,30,31,34)