3-[(2-ethylphenyl)carbamoylamino]-N-[(3-fluorophenyl)methyl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[(2-ethylphenyl)carbamoylamino]-N-[(3-fluorophenyl)methyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[(2-ethylphenyl)carbamoylamino]-N-[(3-fluorophenyl)methyl]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[(2-ethylanilino)-oxomethyl]amino]-N-[(3-fluorophenyl)methyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[(2-ethylphenyl)carbamoylamino]-N-[(3-fluorophenyl)methyl]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[(2-ethylphenyl)carbamoylamino]-N-(3-fluorobenzyl)-4-pyrrolidino-benzamide Formula: C27H29FN4O2 MolecularWeight: 460.543163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC(=CC=C3)F)N4CCCC4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC(=CC=C3)F)N4CCCC4

InChI

InChI=1S/C27H29FN4O2/c1-2-20-9-3-4-11-23(20)30-27(34)31-24-17-21(12-13-25(24)32-14-5-6-15-32)26(33)29-18-19-8-7-10-22(28)16-19/h3-4,7-13,16-17H,2,5-6,14-15,18H2,1H3,(H,29,33)(H2,30,31,34)