1-[4-(3-methylphenyl)piperazin-1-yl]-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-[4-(m-tolyl)piperazin-1-yl]-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-[4-(3-methylphenyl)-1-piperazinyl]-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-[4-(m-tolyl)piperazino]-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]ethanone Formula: C25H24N4OS2 MolecularWeight: 460.61426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=NC4=C3C(=CS4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=NC4=C3C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N4OS2/c1-18-6-5-9-20(14-18)28-10-12-29(13-11-28)22(30)16-32-25-23-21(19-7-3-2-4-8-19)15-31-24(23)26-17-27-25/h2-9,14-15,17H,10-13,16H2,1H3