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

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl(p-anisyl)amino]-1-nicotinoyl-pipecolinamide Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H33N5O3/c1-33-22-8-4-18(5-9-22)17-30(20-6-7-20)21-10-14-29(23(15-21)24(31)28-13-11-26)25(32)19-3-2-12-27-16-19/h2-5,8-9,12,16,20-21,23H,6-7,10-11,13-15,17,26H2,1H3,(H,28,31)/t21?,23-/m1/s1