N-(4-bromophenyl)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(4-bromophenyl)-2-[(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C21H16BrN3OS2 MolecularWeight: 470.40524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN=C2SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(S1)N=CN=C2SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C21H16BrN3OS2/c1-13-18(14-5-3-2-4-6-14)19-20(23-12-24-21(19)28-13)27-11-17(26)25-16-9-7-15(22)8-10-16/h2-10,12H,11H2,1H3,(H,25,26)