4-(4-azanyl-2-pyrrolidin-1-ylcarbonyl-phenyl)-N-cyclohexyl-piperazine-1-carboxamide

Systemtic Name: 4-(4-azanyl-2-pyrrolidin-1-ylcarbonyl-phenyl)-N-cyclohexyl-piperazine-1-carboxamide Openeye Name: 4-[4-amino-2-(pyrrolidine-1-carbonyl)phenyl]-N-cyclohexyl-piperazine-1-carboxamide CAS Name: 4-[4-amino-2-[oxo(1-pyrrolidinyl)methyl]phenyl]-N-cyclohexyl-1-piperazinecarboxamide IUPAC Name: 4-[4-amino-2-(pyrrolidine-1-carbonyl)phenyl]-N-cyclohexylpiperazine-1-carboxamide Traditional Name: 4-[4-amino-2-(pyrrolidine-1-carbonyl)phenyl]-N-cyclohexyl-piperazine-1-carboxamide Formula: C22H33N5O2 MolecularWeight: 399.52972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)N)C(=O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)N)C(=O)N4CCCC4

InChI

InChI=1S/C22H33N5O2/c23-17-8-9-20(19(16-17)21(28)26-10-4-5-11-26)25-12-14-27(15-13-25)22(29)24-18-6-2-1-3-7-18/h8-9,16,18H,1-7,10-15,23H2,(H,24,29)