2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-8-methyl-thieno[3,2-c]chromen-4-one

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-8-methyl-thieno[3,2-c]chromen-4-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-8-methyl-thieno[3,2-c]chromen-4-one CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-8-methyl-4-thieno[3,2-c][1]benzopyranone IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-8-methylthieno[3,2-c]chromen-4-one Traditional Name: 8-methyl-2-(4-piperonylpiperazine-1-carbonyl)thieno[3,2-c]chromen-4-one Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C3=C2SC(=C3)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C3=C2SC(=C3)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H22N2O5S/c1-15-2-4-19-17(10-15)23-18(25(29)32-19)12-22(33-23)24(28)27-8-6-26(7-9-27)13-16-3-5-20-21(11-16)31-14-30-20/h2-5,10-12H,6-9,13-14H2,1H3