4-[(4-bromanyl-2-cyano-phenyl)amino]-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carbonitrile hydrochloride

Systemtic Name: 4-[(4-bromanyl-2-cyano-phenyl)amino]-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carbonitrile hydrochloride Openeye Name: 4-(4-bromo-2-cyano-anilino)-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbonitrile hydrochloride CAS Name: 4-(4-bromo-2-cyanoanilino)-1-[oxo(2-pyrrolidinyl)methyl]-2-pyrrolidinecarbonitrile hydrochloride IUPAC Name: 4-(4-bromo-2-cyanoanilino)-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbonitrile hydrochloride Traditional Name: 4-(4-bromo-2-cyano-anilino)-1-prolyl-pyrrolidine-2-carbonitrile hydrochloride Formula: C17H19BrClN5O MolecularWeight: 424.72266

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N2CC(CC2C#N)NC3=C(C=C(C=C3)Br)C#N.Cl

Isomeric SMILES

C1CC(NC1)C(=O)N2CC(CC2C#N)NC3=C(C=C(C=C3)Br)C#N.Cl

InChI

InChI=1S/C17H18BrN5O.ClH/c18-12-3-4-15(11(6-12)8-19)22-13-7-14(9-20)23(10-13)17(24)16-2-1-5-21-16;/h3-4,6,13-14,16,21-22H,1-2,5,7,10H2;1H