4-methyl-7-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethoxy]chromen-2-one Openeye Name: 4-methyl-7-[2-oxo-2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethoxy]chromen-2-one CAS Name: 4-methyl-7-[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-[2-oxo-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethoxy]chromen-2-one Traditional Name: 7-[2-keto-2-[4-(2-thienylsulfonyl)piperazino]ethoxy]-4-methyl-coumarin Formula: C20H20N2O6S2 MolecularWeight: 448.5126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H20N2O6S2/c1-14-11-19(24)28-17-12-15(4-5-16(14)17)27-13-18(23)21-6-8-22(9-7-21)30(25,26)20-3-2-10-29-20/h2-5,10-12H,6-9,13H2,1H3