[2-(furan-2-yl)quinolin-4-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [2-(furan-2-yl)quinolin-4-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-[2-(2-furyl)-4-quinolyl]methanone CAS Name: [2-(2-furanyl)-4-quinolinyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-[2-(furan-2-yl)quinolin-4-yl]methanone Traditional Name: (4-benzylsulfonylpiperazino)-[2-(2-furyl)-4-quinolyl]methanone Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H23N3O4S/c29-25(21-17-23(24-11-6-16-32-24)26-22-10-5-4-9-20(21)22)27-12-14-28(15-13-27)33(30,31)18-19-7-2-1-3-8-19/h1-11,16-17H,12-15,18H2