(4S)-1-(3,5-dimethylphenyl)-4-(1-hexylbenzimidazol-2-yl)pyrrolidin-2-one

Systemtic Name: (4S)-1-(3,5-dimethylphenyl)-4-(1-hexylbenzimidazol-2-yl)pyrrolidin-2-one Openeye Name: (4S)-1-(3,5-dimethylphenyl)-4-(1-hexylbenzimidazol-2-yl)pyrrolidin-2-one CAS Name: (4S)-1-(3,5-dimethylphenyl)-4-(1-hexyl-2-benzimidazolyl)-2-pyrrolidinone IUPAC Name: (4S)-1-(3,5-dimethylphenyl)-4-(1-hexylbenzimidazol-2-yl)pyrrolidin-2-one Traditional Name: (4S)-1-(3,5-dimethylphenyl)-4-(1-hexylbenzimidazol-2-yl)-2-pyrrolidone Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1C3CC(=O)N(C3)C4=CC(=CC(=C4)C)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1[C@H]3CC(=O)N(C3)C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C25H31N3O/c1-4-5-6-9-12-27-23-11-8-7-10-22(23)26-25(27)20-16-24(29)28(17-20)21-14-18(2)13-19(3)15-21/h7-8,10-11,13-15,20H,4-6,9,12,16-17H2,1-3H3/t20-/m0/s1