3-(4-bromophenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-bromophenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-bromophenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-bromophenyl)-2-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(4-bromophenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-bromophenyl)-2-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]thieno[3,2-d]pyrimidin-4-one Formula: C24H21BrN4O2S2 MolecularWeight: 541.48314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)Br)SC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)Br)SC=C4

InChI

InChI=1S/C24H21BrN4O2S2/c25-17-6-8-19(9-7-17)29-23(31)22-20(10-15-32-22)26-24(29)33-16-21(30)28-13-11-27(12-14-28)18-4-2-1-3-5-18/h1-10,15H,11-14,16H2