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

Systemtic Name: 3-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one CAS Name: 3-[oxo-[4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbonyl]coumarin Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O5S/c1-15-16(2)18(4)23(19(5)17(15)3)33(30,31)27-12-10-26(11-13-27)24(28)21-14-20-8-6-7-9-22(20)32-25(21)29/h6-9,14H,10-13H2,1-5H3