(2R)-N-(2-azanylethyl)-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl(o-tolylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-(2-methylbenzyl)amino]-1-nicotinoyl-pipecolinamide Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C2CC2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN(C2CC2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H33N5O2/c1-18-5-2-3-6-20(18)17-30(21-8-9-21)22-10-14-29(23(15-22)24(31)28-13-11-26)25(32)19-7-4-12-27-16-19/h2-7,12,16,21-23H,8-11,13-15,17,26H2,1H3,(H,28,31)/t22?,23-/m1/s1