1-[(4-azanylquinolin-7-yl)methyl]-3-[(6-chloranyl-1-benzothiophen-2-yl)methylamino]pyrrolidin-2-one

Systemtic Name: 1-[(4-azanylquinolin-7-yl)methyl]-3-[(6-chloranyl-1-benzothiophen-2-yl)methylamino]pyrrolidin-2-one Openeye Name: 1-[(4-amino-7-quinolyl)methyl]-3-[(6-chlorobenzothiophen-2-yl)methylamino]pyrrolidin-2-one CAS Name: 1-[(4-amino-7-quinolinyl)methyl]-3-[(6-chloro-1-benzothiophen-2-yl)methylamino]-2-pyrrolidinone IUPAC Name: 1-[(4-aminoquinolin-7-yl)methyl]-3-[(6-chloro-1-benzothiophen-2-yl)methylamino]pyrrolidin-2-one Traditional Name: 1-[(4-amino-7-quinolyl)methyl]-3-[(6-chlorobenzothiophen-2-yl)methylamino]-2-pyrrolidone Formula: C23H21ClN4OS MolecularWeight: 436.95704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NCC2=CC3=C(S2)C=C(C=C3)Cl)CC4=CC5=NC=CC(=C5C=C4)N

Isomeric SMILES

C1CN(C(=O)C1NCC2=CC3=C(S2)C=C(C=C3)Cl)CC4=CC5=NC=CC(=C5C=C4)N

InChI

InChI=1S/C23H21ClN4OS/c24-16-3-2-15-10-17(30-22(15)11-16)12-27-20-6-8-28(23(20)29)13-14-1-4-18-19(25)5-7-26-21(18)9-14/h1-5,7,9-11,20,27H,6,8,12-13H2,(H2,25,26)