5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-N-phenethyl-2-piperidin-1-yl-benzamide

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-N-phenethyl-2-piperidin-1-yl-benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-phenethyl-2-(1-piperidyl)benzamide CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-N-phenethyl-2-(1-piperidinyl)benzamide IUPAC Name: 5-[(3-chloro-4-fluorophenyl)carbamoylamino]-N-phenethyl-2-piperidin-1-ylbenzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-phenethyl-2-piperidino-benzamide Formula: C27H28ClFN4O2 MolecularWeight: 494.988223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H28ClFN4O2/c28-23-18-21(9-11-24(23)29)32-27(35)31-20-10-12-25(33-15-5-2-6-16-33)22(17-20)26(34)30-14-13-19-7-3-1-4-8-19/h1,3-4,7-12,17-18H,2,5-6,13-16H2,(H,30,34)(H2,31,32,35)