N-[4-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-2-bromanyl-benzamide

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-2-bromanyl-benzamide Openeye Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-bromo-benzamide CAS Name: N-[4-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-2-bromobenzamide IUPAC Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-bromobenzamide Traditional Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-bromo-benzamide Formula: C24H28BrN3O2 MolecularWeight: 470.40202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3Br)C(=O)C4CC4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3Br)C(=O)C4CC4

InChI

InChI=1S/C24H28BrN3O2/c25-20-6-2-1-5-19(20)23(29)27-18-13-9-16(10-14-18)15-28(24(30)17-11-12-17)22-8-4-3-7-21(22)26/h1-2,5-6,9-10,13-14,17,21-22H,3-4,7-8,11-12,15,26H2,(H,27,29)