3-[[4-(6-azanylpyridin-3-yl)-2-chloranyl-phenyl]methyl]-1-cyclohexyl-pyrrolidin-2-one

Systemtic Name: 3-[[4-(6-azanylpyridin-3-yl)-2-chloranyl-phenyl]methyl]-1-cyclohexyl-pyrrolidin-2-one Openeye Name: 3-[[4-(6-amino-3-pyridyl)-2-chloro-phenyl]methyl]-1-cyclohexyl-pyrrolidin-2-one CAS Name: 3-[[4-(6-amino-3-pyridinyl)-2-chlorophenyl]methyl]-1-cyclohexyl-2-pyrrolidinone IUPAC Name: 3-[[4-(6-aminopyridin-3-yl)-2-chlorophenyl]methyl]-1-cyclohexylpyrrolidin-2-one Traditional Name: 3-[4-(6-amino-3-pyridyl)-2-chloro-benzyl]-1-cyclohexyl-2-pyrrolidone Formula: C22H26ClN3O MolecularWeight: 383.91434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCC(C2=O)CC3=C(C=C(C=C3)C4=CN=C(C=C4)N)Cl

Isomeric SMILES

C1CCC(CC1)N2CCC(C2=O)CC3=C(C=C(C=C3)C4=CN=C(C=C4)N)Cl

InChI

InChI=1S/C22H26ClN3O/c23-20-13-15(18-8-9-21(24)25-14-18)6-7-16(20)12-17-10-11-26(22(17)27)19-4-2-1-3-5-19/h6-9,13-14,17,19H,1-5,10-12H2,(H2,24,25)