4-[4-(propanoylamino)-2-pyrrolidin-1-ylcarbonyl-phenyl]-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[4-(propanoylamino)-2-pyrrolidin-1-ylcarbonyl-phenyl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: N-isopropyl-4-[4-(propanoylamino)-2-(pyrrolidine-1-carbonyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[4-(1-oxopropylamino)-2-[oxo(1-pyrrolidinyl)methyl]phenyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[4-(propanoylamino)-2-(pyrrolidine-1-carbonyl)phenyl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: N-isopropyl-4-[4-propionamido-2-(pyrrolidine-1-carbonyl)phenyl]piperazine-1-carboxamide Formula: C22H33N5O3 MolecularWeight: 415.52912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)NC(C)C)C(=O)N3CCCC3

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)NC(C)C)C(=O)N3CCCC3

InChI

InChI=1S/C22H33N5O3/c1-4-20(28)24-17-7-8-19(18(15-17)21(29)26-9-5-6-10-26)25-11-13-27(14-12-25)22(30)23-16(2)3/h7-8,15-16H,4-6,9-14H2,1-3H3,(H,23,30)(H,24,28)