1-[4-[bis[(4-cyanophenyl)methyl]amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile dihydrochloride

Systemtic Name: 1-[4-[bis[(4-cyanophenyl)methyl]amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile dihydrochloride Openeye Name: 1-[4-[bis[(4-cyanophenyl)methyl]amino]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile dihydrochloride CAS Name: 1-[[4-[bis[(4-cyanophenyl)methyl]amino]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile dihydrochloride IUPAC Name: 1-[4-[bis[(4-cyanophenyl)methyl]amino]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile dihydrochloride Traditional Name: 1-[4-[bis(4-cyanobenzyl)amino]prolyl]pyrrolidine-2-carbonitrile dihydrochloride Formula: C26H28Cl2N6O MolecularWeight: 511.44612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)N(CC3=CC=C(C=C3)C#N)CC4=CC=C(C=C4)C#N)C#N.Cl.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2)N(CC3=CC=C(C=C3)C#N)CC4=CC=C(C=C4)C#N)C#N.Cl.Cl

InChI

InChI=1S/C26H26N6O.2ClH/c27-13-19-3-7-21(8-4-19)17-31(18-22-9-5-20(14-28)6-10-22)24-12-25(30-16-24)26(33)32-11-1-2-23(32)15-29;;/h3-10,23-25,30H,1-2,11-12,16-18H2;2*1H