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

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-N-(1-phenylethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-chloro-4-fluorophenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidino-benzamide Formula: C26H26ClFN4O2 MolecularWeight: 480.961643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)N4CCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)N4CCCC4

InChI

InChI=1S/C26H26ClFN4O2/c1-17(18-7-3-2-4-8-18)29-25(33)21-15-19(10-12-24(21)32-13-5-6-14-32)30-26(34)31-20-9-11-23(28)22(27)16-20/h2-4,7-12,15-17H,5-6,13-14H2,1H3,(H,29,33)(H2,30,31,34)