5-(4-methylpiperazin-1-yl)-2,3,4,5-tetrahydro-1-benzothiocin-6-one

Systemtic Name: 5-(4-methylpiperazin-1-yl)-2,3,4,5-tetrahydro-1-benzothiocin-6-one Openeye Name: 5-(4-methylpiperazin-1-yl)-2,3,4,5-tetrahydro-1-benzothiocin-6-one CAS Name: 5-(4-methyl-1-piperazinyl)-2,3,4,5-tetrahydro-1-benzothiocin-6-one IUPAC Name: 5-(4-methylpiperazin-1-yl)-2,3,4,5-tetrahydro-1-benzothiocin-6-one Traditional Name: 5-(4-methylpiperazino)-2,3,4,5-tetrahydro-1-benzothiocin-6-one Formula: C16H22N2OS MolecularWeight: 290.42368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCCSC3=CC=CC=C3C2=O

Isomeric SMILES

CN1CCN(CC1)C2CCCSC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H22N2OS/c1-17-8-10-18(11-9-17)14-6-4-12-20-15-7-3-2-5-13(15)16(14)19/h2-3,5,7,14H,4,6,8-12H2,1H3