2-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl-cyclohexyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl-cyclohexyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3-chloro-4-fluoro-phenyl)carbamoyl-cyclohexyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(3-chloro-4-fluoroanilino)-oxomethyl]-cyclohexylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3-chloro-4-fluorophenyl)carbamoyl-cyclohexylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[(3-chloro-4-fluoro-phenyl)carbamoyl-cyclohexyl-amino]-N-(2-thenyl)acetamide Formula: C27H29ClFN3O2S MolecularWeight: 514.054463

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CCC(CC1)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C27H29ClFN3O2S/c28-24-16-21(13-14-25(24)29)30-27(34)32(22-10-5-2-6-11-22)19-26(33)31(18-23-12-7-15-35-23)17-20-8-3-1-4-9-20/h1,3-4,7-9,12-16,22H,2,5-6,10-11,17-19H2,(H,30,34)