4-cyano-N-[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-3-yl]benzamide hydrochloride

Systemtic Name: 4-cyano-N-[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-3-yl]benzamide hydrochloride Openeye Name: 4-cyano-N-[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-3-yl]benzamide hydrochloride CAS Name: 4-cyano-N-[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-3-pyrrolidinyl]benzamide hydrochloride IUPAC Name: 4-cyano-N-[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-3-yl]benzamide hydrochloride Traditional Name: 4-cyano-N-[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-3-yl]benzamide hydrochloride Formula: C18H20ClN5O2 MolecularWeight: 373.8367

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)NC(=O)C3=CC=C(C=C3)C#N)C#N.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2)NC(=O)C3=CC=C(C=C3)C#N)C#N.Cl

InChI

InChI=1S/C18H19N5O2.ClH/c19-9-12-3-5-13(6-4-12)17(24)22-14-8-16(21-11-14)18(25)23-7-1-2-15(23)10-20;/h3-6,14-16,21H,1-2,7-8,11H2,(H,22,24);1H