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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-5-methyl-thieno[3,2-c]quinolin-4-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-5-methyl-thieno[3,2-c]quinolin-4-one CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-5-methyl-4-thieno[3,2-c]quinolinone IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-5-methylthieno[3,2-c]quinolin-4-one Traditional Name: 5-methyl-2-(4-piperonylpiperazine-1-carbonyl)thieno[3,2-c]quinolin-4-one Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H23N3O4S/c1-26-19-5-3-2-4-17(19)23-18(24(26)29)13-22(33-23)25(30)28-10-8-27(9-11-28)14-16-6-7-20-21(12-16)32-15-31-20/h2-7,12-13H,8-11,14-15H2,1H3