10-[(4-methylpiperazin-1-yl)methyl]-6H-[1]benzothiolo[3,2-c]isoquinolin-5-one

Systemtic Name: 10-[(4-methylpiperazin-1-yl)methyl]-6H-[1]benzothiolo[3,2-c]isoquinolin-5-one Openeye Name: 10-[(4-methylpiperazin-1-yl)methyl]-6H-benzothiopheno[3,2-c]isoquinolin-5-one CAS Name: 10-[(4-methyl-1-piperazinyl)methyl]-6H-[1]benzothiolo[3,2-c]isoquinolin-5-one IUPAC Name: 10-[(4-methylpiperazin-1-yl)methyl]-6H-[1]benzothiolo[3,2-c]isoquinolin-5-one Traditional Name: 10-[(4-methylpiperazino)methyl]-6H-benzothiophen[3,2-c]isoquinolin-5-one Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=CC3=C2SC4=C3NC(=O)C5=CC=CC=C54

Isomeric SMILES

CN1CCN(CC1)CC2=CC=CC3=C2SC4=C3NC(=O)C5=CC=CC=C54

InChI

InChI=1S/C21H21N3OS/c1-23-9-11-24(12-10-23)13-14-5-4-8-17-18-20(26-19(14)17)15-6-2-3-7-16(15)21(25)22-18/h2-8H,9-13H2,1H3,(H,22,25)