5-[(3-ethylphenyl)carbamoylamino]-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(3-ethylphenyl)carbamoylamino]-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-ethylphenyl)carbamoylamino]-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-ethylanilino)-oxomethyl]amino]-N-[(4-fluorophenyl)methyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-ethylphenyl)carbamoylamino]-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-ethylphenyl)carbamoylamino]-N-(4-fluorobenzyl)-2-pyrrolidino-benzamide Formula: C27H29FN4O2 MolecularWeight: 460.543163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C27H29FN4O2/c1-2-19-6-5-7-22(16-19)30-27(34)31-23-12-13-25(32-14-3-4-15-32)24(17-23)26(33)29-18-20-8-10-21(28)11-9-20/h5-13,16-17H,2-4,14-15,18H2,1H3,(H,29,33)(H2,30,31,34)