3-phenyl-6-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-3,4-dihydroisochromen-1-one

Systemtic Name: 3-phenyl-6-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-3,4-dihydroisochromen-1-one Openeye Name: 3-phenyl-6-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]isochroman-1-one CAS Name: 6-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]-3-phenyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-phenyl-6-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)-3,4-dihydroisochromen-1-one Traditional Name: 3-phenyl-6-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]isochroman-1-one Formula: C24H22N2O5S2 MolecularWeight: 482.57188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C24H22N2O5S2/c27-23(25-10-12-26(13-11-25)33(29,30)22-7-4-14-32-22)18-8-9-20-19(15-18)16-21(31-24(20)28)17-5-2-1-3-6-17/h1-9,14-15,21H,10-13,16H2