2-[(2S)-1-(3,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole

Systemtic Name: 2-[(2S)-1-(3,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole Openeye Name: 2-[(2S)-1-(3,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole CAS Name: 2-[(2S)-1-(3,4-dimethylphenyl)sulfonyl-2-pyrrolidinyl]-1H-benzimidazole IUPAC Name: 2-[(2S)-1-(3,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole Traditional Name: 2-[(2S)-1-(3,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1H-benzimidazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2C3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC[C@H]2C3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C19H21N3O2S/c1-13-9-10-15(12-14(13)2)25(23,24)22-11-5-8-18(22)19-20-16-6-3-4-7-17(16)21-19/h3-4,6-7,9-10,12,18H,5,8,11H2,1-2H3,(H,20,21)/t18-/m0/s1