[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-(4-pyrrolidinosulfonylphenyl)methanone Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H25N3O3S2/c27-23(18-7-9-19(10-8-18)31(28,29)26-13-3-4-14-26)25-15-11-17(12-16-25)22-24-20-5-1-2-6-21(20)30-22/h1-2,5-10,17H,3-4,11-16H2