2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[4-(1-naphthylmethyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[4-(1-naphthalenylmethyl)-1-piperazinyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[4-(1-naphthylmethyl)piperazino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)CC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)CC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C22H22N4OS/c27-22-21-19(8-13-28-21)23-20(24-22)15-26-11-9-25(10-12-26)14-17-6-3-5-16-4-1-2-7-18(16)17/h1-8,13H,9-12,14-15H2,(H,23,24,27)