(2S)-1-[(2S)-1-[3-(azepan-1-ylcarbonyl)phenyl]carbonylpyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[(2S)-1-[3-(azepan-1-ylcarbonyl)phenyl]carbonylpyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[(2S)-1-[3-(azepane-1-carbonyl)benzoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[[(2S)-1-[[3-[1-azepanyl(oxo)methyl]phenyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[(2S)-1-[3-(azepane-1-carbonyl)benzoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[(2S)-1-[3-(azepane-1-carbonyl)benzoyl]prolyl]pyrrolidine-2-carbonitrile Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)C(=O)N3CCCC3C(=O)N4CCCC4C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C#N

InChI

InChI=1S/C24H30N4O3/c25-17-20-10-6-14-27(20)24(31)21-11-7-15-28(21)23(30)19-9-5-8-18(16-19)22(29)26-12-3-1-2-4-13-26/h5,8-9,16,20-21H,1-4,6-7,10-15H2/t20-,21-/m0/s1