N-(2-azanylethyl)-4-[2-methylpropanoyl(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[2-methylpropanoyl(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[isobutyl(2-methylpropanoyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(2-methyl-1-oxopropyl)-(2-methylpropyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[2-methylpropanoyl(2-methylpropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[isobutyl(isobutyryl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C21H33N5O3 MolecularWeight: 403.51842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1CC(N(C1)C(=O)C2=CN=CC=C2)C(=O)NCCN)C(=O)C(C)C

Isomeric SMILES

CC(C)CN(C1CC(N(C1)C(=O)C2=CN=CC=C2)C(=O)NCCN)C(=O)C(C)C

InChI

InChI=1S/C21H33N5O3/c1-14(2)12-25(20(28)15(3)4)17-10-18(19(27)24-9-7-22)26(13-17)21(29)16-6-5-8-23-11-16/h5-6,8,11,14-15,17-18H,7,9-10,12-13,22H2,1-4H3,(H,24,27)