5-(2-methylphenyl)-2-[(3-methylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(2-methylphenyl)-2-[(3-methylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-methylpiperazin-1-yl)methyl]-5-(o-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(2-methylphenyl)-2-[(3-methyl-1-piperazinyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(2-methylphenyl)-2-[(3-methylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(3-methylpiperazino)methyl]-5-(o-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H22N4OS MolecularWeight: 354.46918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=NC3=C(C(=CS3)C4=CC=CC=C4C)C(=O)N2

Isomeric SMILES

CC1CN(CCN1)CC2=NC3=C(C(=CS3)C4=CC=CC=C4C)C(=O)N2

InChI

InChI=1S/C19H22N4OS/c1-12-5-3-4-6-14(12)15-11-25-19-17(15)18(24)21-16(22-19)10-23-8-7-20-13(2)9-23/h3-6,11,13,20H,7-10H2,1-2H3,(H,21,22,24)