7-methyl-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-6-propan-2-yl-chromen-2-one Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[(4-besylpiperazino)methyl]-6-isopropyl-7-methyl-coumarin Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C24H28N2O4S/c1-17(2)21-15-22-19(14-24(27)30-23(22)13-18(21)3)16-25-9-11-26(12-10-25)31(28,29)20-7-5-4-6-8-20/h4-8,13-15,17H,9-12,16H2,1-3H3