N-(2-azanylethyl)-4-[3,3-dimethylbutanoyl(oxolan-2-ylmethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[3,3-dimethylbutanoyl(oxolan-2-ylmethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[3,3-dimethylbutanoyl(tetrahydrofuran-2-ylmethyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(3,3-dimethyl-1-oxobutyl)-(2-oxolanylmethyl)amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[3,3-dimethylbutanoyl(oxolan-2-ylmethyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[3,3-dimethylbutanoyl(tetrahydrofurfuryl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C26H40N4O4 MolecularWeight: 472.6202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3CCCO3)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3CCCO3)C(=O)CC(C)(C)C

InChI

InChI=1S/C26H40N4O4/c1-18-7-9-19(10-8-18)25(33)30-16-20(14-22(30)24(32)28-12-11-27)29(17-21-6-5-13-34-21)23(31)15-26(2,3)4/h7-10,20-22H,5-6,11-17,27H2,1-4H3,(H,28,32)