3-bromanyl-N-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide Openeye Name: 3-bromo-N-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxo-thieno[3,2-d]pyrimidin-3-yl]benzamide CAS Name: 3-bromo-N-[2-[(2-chlorophenyl)methylthio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]benzamide IUPAC Name: 3-bromo-N-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxothieno[3,2-d]pyrimidin-3-yl]benzamide Traditional Name: 3-bromo-N-[2-[(2-chlorobenzyl)thio]-4-keto-thieno[3,2-d]pyrimidin-3-yl]benzamide Formula: C20H13BrClN3O2S2 MolecularWeight: 506.82312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=C(C(=O)N2NC(=O)C4=CC(=CC=C4)Br)SC=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=C(C(=O)N2NC(=O)C4=CC(=CC=C4)Br)SC=C3)Cl

InChI

InChI=1S/C20H13BrClN3O2S2/c21-14-6-3-5-12(10-14)18(26)24-25-19(27)17-16(8-9-28-17)23-20(25)29-11-13-4-1-2-7-15(13)22/h1-10H,11H2,(H,24,26)