3-azanyl-2-[(4-bromophenyl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[(4-bromophenyl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[(4-bromophenyl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[(4-bromophenyl)methylthio]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[(4-bromophenyl)methylsulfanyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[(4-bromobenzyl)thio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H14BrN3OS2 MolecularWeight: 444.36796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)Br)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)Br)N

InChI

InChI=1S/C19H14BrN3OS2/c20-14-8-6-12(7-9-14)10-26-19-22-17-16(18(24)23(19)21)15(11-25-17)13-4-2-1-3-5-13/h1-9,11H,10,21H2