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

Systemtic Name: 4-[4-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]sulfonylmorpholine Openeye Name: 4-[4-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]sulfonylmorpholine CAS Name: 4-[4-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]sulfonyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[4-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]sulfonylphenyl]sulfonylmorpholine Traditional Name: 4-[4-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]sulfonylphenyl]sulfonylmorpholine Formula: C21H23N3O5S3 MolecularWeight: 493.61942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H23N3O5S3/c25-31(26,23-12-14-29-15-13-23)16-7-9-17(10-8-16)32(27,28)24-11-3-5-19(24)21-22-18-4-1-2-6-20(18)30-21/h1-2,4,6-10,19H,3,5,11-15H2/t19-/m1/s1