7-methyl-6-propan-2-yl-4-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 7-methyl-6-propan-2-yl-4-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-[[4-(2-thienylmethyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 7-methyl-6-propan-2-yl-4-[[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-6-propan-2-yl-4-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[[4-(2-thenyl)piperazino]methyl]coumarin Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)CC4=CC=CS4)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)CC4=CC=CS4)C(C)C

InChI

InChI=1S/C23H28N2O2S/c1-16(2)20-13-21-18(12-23(26)27-22(21)11-17(20)3)14-24-6-8-25(9-7-24)15-19-5-4-10-28-19/h4-5,10-13,16H,6-9,14-15H2,1-3H3