4-[[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]-7-methyl-chromen-2-one Openeye Name: 4-[[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]methyl]-7-methyl-chromen-2-one CAS Name: 4-[[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]methyl]-7-methylchromen-2-one Traditional Name: 4-[[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]methyl]-7-methyl-coumarin Formula: C19H19BrN2O4S2 MolecularWeight: 483.39916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C19H19BrN2O4S2/c1-13-2-3-15-14(11-18(23)26-16(15)10-13)12-21-6-8-22(9-7-21)28(24,25)19-5-4-17(20)27-19/h2-5,10-11H,6-9,12H2,1H3