4-(1-azanylpropan-2-yl)-N-(phenylmethyl)-N-[2-[(phenylmethyl)amino]pyridin-4-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-(1-azanylpropan-2-yl)-N-(phenylmethyl)-N-[2-[(phenylmethyl)amino]pyridin-4-yl]cyclohexane-1-carboxamide Openeye Name: 4-(2-amino-1-methyl-ethyl)-N-benzyl-N-[2-(benzylamino)-4-pyridyl]cyclohexanecarboxamide CAS Name: 4-(1-aminopropan-2-yl)-N-(phenylmethyl)-N-[2-[(phenylmethyl)amino]-4-pyridinyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(1-aminopropan-2-yl)-N-benzyl-N-[2-(benzylamino)pyridin-4-yl]cyclohexane-1-carboxamide Traditional Name: 4-(2-amino-1-methyl-ethyl)-N-benzyl-N-[2-(benzylamino)-4-pyridyl]cyclohexanecarboxamide Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)C1CCC(CC1)C(=O)N(CC2=CC=CC=C2)C3=CC(=NC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CC(CN)C1CCC(CC1)C(=O)N(CC2=CC=CC=C2)C3=CC(=NC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C29H36N4O/c1-22(19-30)25-12-14-26(15-13-25)29(34)33(21-24-10-6-3-7-11-24)27-16-17-31-28(18-27)32-20-23-8-4-2-5-9-23/h2-11,16-18,22,25-26H,12-15,19-21,30H2,1H3,(H,31,32)