(4S)-4-(1-butylbenzimidazol-2-yl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one

Systemtic Name: (4S)-4-(1-butylbenzimidazol-2-yl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one Openeye Name: (4S)-4-(1-butylbenzimidazol-2-yl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one CAS Name: (4S)-4-(1-butyl-2-benzimidazolyl)-1-[3-(methylthio)phenyl]-2-pyrrolidinone IUPAC Name: (4S)-4-(1-butylbenzimidazol-2-yl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one Traditional Name: (4S)-4-(1-butylbenzimidazol-2-yl)-1-[3-(methylthio)phenyl]-2-pyrrolidone Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C1C3CC(=O)N(C3)C4=CC(=CC=C4)SC

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C1[C@H]3CC(=O)N(C3)C4=CC(=CC=C4)SC

InChI

InChI=1S/C22H25N3OS/c1-3-4-12-24-20-11-6-5-10-19(20)23-22(24)16-13-21(26)25(15-16)17-8-7-9-18(14-17)27-2/h5-11,14,16H,3-4,12-13,15H2,1-2H3/t16-/m0/s1