N-(2-azanylethyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclopropanecarbonyl(phenethyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(2-aminoethyl)-4-[[cyclopropyl(oxo)methyl]-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclopropanecarbonyl(phenethyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclopropanecarbonyl(phenethyl)amino]pyrrolidine-2-carboxamide Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NCCN)N(CCC2=CC=CC=C2)C(=O)C3CC3

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NCCN)N(CCC2=CC=CC=C2)C(=O)C3CC3

InChI

InChI=1S/C21H30N4O3/c1-15(26)25-14-18(13-19(25)20(27)23-11-10-22)24(21(28)17-7-8-17)12-9-16-5-3-2-4-6-16/h2-6,17-19H,7-14,22H2,1H3,(H,23,27)