2-[1-(2,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(2,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Openeye Name: 2-[1-(2,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole CAS Name: 2-[1-(2,4-dimethylphenyl)sulfonyl-2-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-(2,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Traditional Name: 2-[1-(2,4-dimethylphenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCCC2C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCCC2C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C19H20N2O2S2/c1-13-9-10-18(14(2)12-13)25(22,23)21-11-5-7-16(21)19-20-15-6-3-4-8-17(15)24-19/h3-4,6,8-10,12,16H,5,7,11H2,1-2H3