4-[2-(4-methylsulfonylpiperazin-1-yl)ethylamino]chromen-2-one

Systemtic Name: 4-[2-(4-methylsulfonylpiperazin-1-yl)ethylamino]chromen-2-one Openeye Name: 4-[2-(4-methylsulfonylpiperazin-1-yl)ethylamino]chromen-2-one CAS Name: 4-[2-(4-methylsulfonyl-1-piperazinyl)ethylamino]-1-benzopyran-2-one IUPAC Name: 4-[2-(4-methylsulfonylpiperazin-1-yl)ethylamino]chromen-2-one Traditional Name: 4-[2-(4-mesylpiperazino)ethylamino]coumarin Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CCNC2=CC(=O)OC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CCNC2=CC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C16H21N3O4S/c1-24(21,22)19-10-8-18(9-11-19)7-6-17-14-12-16(20)23-15-5-3-2-4-13(14)15/h2-5,12,17H,6-11H2,1H3