5-ethyl-2-[4-(phenylmethyl)piperazin-1-yl]carbonyl-thieno[3,2-c]quinolin-4-one

Systemtic Name: 5-ethyl-2-[4-(phenylmethyl)piperazin-1-yl]carbonyl-thieno[3,2-c]quinolin-4-one Openeye Name: 2-(4-benzylpiperazine-1-carbonyl)-5-ethyl-thieno[3,2-c]quinolin-4-one CAS Name: 5-ethyl-2-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-4-thieno[3,2-c]quinolinone IUPAC Name: 2-(4-benzylpiperazine-1-carbonyl)-5-ethylthieno[3,2-c]quinolin-4-one Traditional Name: 2-(4-benzylpiperazine-1-carbonyl)-5-ethyl-thieno[3,2-c]quinolin-4-one Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H25N3O2S/c1-2-28-21-11-7-6-10-19(21)23-20(24(28)29)16-22(31-23)25(30)27-14-12-26(13-15-27)17-18-8-4-3-5-9-18/h3-11,16H,2,12-15,17H2,1H3