1-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidino]sulfonylphenyl]ethanone Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O3S2/c1-13(22)14-8-10-15(11-9-14)26(23,24)21-12-4-6-17(21)19-20-16-5-2-3-7-18(16)25-19/h2-3,5,7-11,17H,4,6,12H2,1H3