6-ethyl-4-methyl-7-oxidanyl-8-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]chromen-2-one

Systemtic Name: 6-ethyl-4-methyl-7-oxidanyl-8-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-methyl-8-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-methyl-8-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-methyl-8-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-methyl-8-[[4-(2-thenoyl)piperazino]methyl]coumarin Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)CN3CCN(CC3)C(=O)C4=CC=CS4)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)CN3CCN(CC3)C(=O)C4=CC=CS4)O

InChI

InChI=1S/C22H24N2O4S/c1-3-15-12-16-14(2)11-19(25)28-21(16)17(20(15)26)13-23-6-8-24(9-7-23)22(27)18-5-4-10-29-18/h4-5,10-12,26H,3,6-9,13H2,1-2H3