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

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[2-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-tert-butyl-benzamide Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2CN(C3CCCCC3N)C(=O)C4CC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2CN(C3CCCCC3N)C(=O)C4CC4

InChI

InChI=1S/C28H37N3O2/c1-28(2,3)22-16-14-19(15-17-22)26(32)30-24-10-6-4-8-21(24)18-31(27(33)20-12-13-20)25-11-7-5-9-23(25)29/h4,6,8,10,14-17,20,23,25H,5,7,9,11-13,18,29H2,1-3H3,(H,30,32)