N-(2-azanylethyl)-4-[3,3-dimethylbutanoyl-[(3-methoxyphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[3,3-dimethylbutanoyl-[(3-methoxyphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[3,3-dimethylbutanoyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(3,3-dimethyl-1-oxobutyl)-[(3-methoxyphenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[3,3-dimethylbutanoyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[3,3-dimethylbutanoyl(m-anisyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C27H37N5O4 MolecularWeight: 495.61378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC(=CC=C1)OC)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC(=CC=C1)OC)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN

InChI

InChI=1S/C27H37N5O4/c1-27(2,3)15-24(33)31(17-19-7-5-9-22(13-19)36-4)21-14-23(25(34)30-12-10-28)32(18-21)26(35)20-8-6-11-29-16-20/h5-9,11,13,16,21,23H,10,12,14-15,17-18,28H2,1-4H3,(H,30,34)