(2S)-N-[(4-azanylcyclohexyl)methyl]-1-(2-azanyl-3,3-diphenyl-propanoyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-azanylcyclohexyl)methyl]-1-(2-azanyl-3,3-diphenyl-propanoyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2-amino-3,3-diphenyl-propanoyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2-amino-1-oxo-3,3-diphenylpropyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2-amino-3,3-diphenylpropanoyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2-amino-3,3-diphenyl-propanoyl)pyrrolidine-2-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(C(C2=CC=CC=C2)C3=CC=CC=C3)N)C(=O)NCC4CCC(CC4)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C(C(C2=CC=CC=C2)C3=CC=CC=C3)N)C(=O)NCC4CCC(CC4)N

InChI

InChI=1S/C27H36N4O2/c28-22-15-13-19(14-16-22)18-30-26(32)23-12-7-17-31(23)27(33)25(29)24(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-11,19,22-25H,7,12-18,28-29H2,(H,30,32)/t19?,22?,23-,25?/m0/s1