2-[(3-chlorophenyl)methylamino]-N-(2-methylpropyl)-N-(2-methylsulfanylcyclopentyl)-1,3-benzoxazole-5-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methylamino]-N-(2-methylpropyl)-N-(2-methylsulfanylcyclopentyl)-1,3-benzoxazole-5-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylamino]-N-isobutyl-N-(2-methylsulfanylcyclopentyl)-1,3-benzoxazole-5-carboxamide CAS Name: 2-[(3-chlorophenyl)methylamino]-N-(2-methylpropyl)-N-[2-(methylthio)cyclopentyl]-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-[(3-chlorophenyl)methylamino]-N-(2-methylpropyl)-N-(2-methylsulfanylcyclopentyl)-1,3-benzoxazole-5-carboxamide Traditional Name: 2-[(3-chlorobenzyl)amino]-N-isobutyl-N-[2-(methylthio)cyclopentyl]-1,3-benzoxazole-5-carboxamide Formula: C25H30ClN3O2S MolecularWeight: 472.0426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1CCCC1SC)C(=O)C2=CC3=C(C=C2)OC(=N3)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)CN(C1CCCC1SC)C(=O)C2=CC3=C(C=C2)OC(=N3)NCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H30ClN3O2S/c1-16(2)15-29(21-8-5-9-23(21)32-3)24(30)18-10-11-22-20(13-18)28-25(31-22)27-14-17-6-4-7-19(26)12-17/h4,6-7,10-13,16,21,23H,5,8-9,14-15H2,1-3H3,(H,27,28)