6-chloranyl-7-methyl-4-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-chloro-4-[[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(4-p-cumenylsulfonylpiperazino)methyl]coumarin Formula: C24H27ClN2O4S MolecularWeight: 475.00018

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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=C(C=C4)C(C)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClN2O4S/c1-16(2)18-4-6-20(7-5-18)32(29,30)27-10-8-26(9-11-27)15-19-13-24(28)31-23-12-17(3)22(25)14-21(19)23/h4-7,12-14,16H,8-11,15H2,1-3H3