2-[4-(5-bromanyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[4-(5-bromanyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[4-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[4-(5-bromo-3,4-dimethyl-2-thieno[2,3-b]thiophenyl)-2-pyrimidinyl]thio]-N-phenylacetamide IUPAC Name: 2-[4-(5-bromo-3,4-dimethylthieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[4-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]thio]-N-phenyl-acetamide Formula: C20H16BrN3OS3 MolecularWeight: 490.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=C(S2)Br)C)C3=NC(=NC=C3)SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=C(S2)Br)C)C3=NC(=NC=C3)SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H16BrN3OS3/c1-11-16-12(2)18(21)28-19(16)27-17(11)14-8-9-22-20(24-14)26-10-15(25)23-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,23,25)