3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one CAS Name: 3-[oxo-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]coumarin Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O)C)C

InChI

InChI=1S/C24H26N2O5S/c1-15-13-16(2)18(4)22(17(15)3)32(29,30)26-11-9-25(10-12-26)23(27)20-14-19-7-5-6-8-21(19)31-24(20)28/h5-8,13-14H,9-12H2,1-4H3