4-[2-[(4-bromophenyl)sulfanylmethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one

Systemtic Name: 4-[2-[(4-bromophenyl)sulfanylmethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one Openeye Name: 4-[2-[(4-bromophenyl)sulfanylmethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one CAS Name: 4-[2-[[(4-bromophenyl)thio]methyl]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl]-2-piperazinone IUPAC Name: 4-[2-[(4-bromophenyl)sulfanylmethyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl]piperazin-2-one Traditional Name: 4-[2-[[(4-bromophenyl)thio]methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one Formula: C19H19BrN4OS2 MolecularWeight: 463.41436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCNC(=O)C3)CSC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCNC(=O)C3)CSC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C19H19BrN4OS2/c1-11-12(2)27-19-17(11)18(24-8-7-21-16(25)9-24)22-15(23-19)10-26-14-5-3-13(20)4-6-14/h3-6H,7-10H2,1-2H3,(H,21,25)