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

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[4-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[4-[[(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=C(C=C2)CN(C3CCCCC3N)C(=O)C4CC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(C3CCCCC3N)C(=O)C4CC4

InChI

InChI=1S/C28H37N3O2/c1-28(2,3)22-14-12-20(13-15-22)26(32)30-23-16-8-19(9-17-23)18-31(27(33)21-10-11-21)25-7-5-4-6-24(25)29/h8-9,12-17,21,24-25H,4-7,10-11,18,29H2,1-3H3,(H,30,32)