2-[3-(furan-2-ylmethyl)-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-[2,4,6-tris(bromanyl)phenyl]ethanamide

Systemtic Name: 2-[3-(furan-2-ylmethyl)-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-[2,4,6-tris(bromanyl)phenyl]ethanamide Openeye Name: 2-[3-(2-furylmethyl)-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2,4,6-tribromophenyl)acetamide CAS Name: 2-[[3-(2-furanylmethyl)-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-N-(2,4,6-tribromophenyl)acetamide IUPAC Name: 2-[3-(furan-2-ylmethyl)-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2,4,6-tribromophenyl)acetamide Traditional Name: 2-[[3-(2-furfuryl)-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]thio]-N-(2,4,6-tribromophenyl)acetamide Formula: C21H16Br3N3O3S2 MolecularWeight: 662.21204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3Br)Br)Br)CC4=CC=CO4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3Br)Br)Br)CC4=CC=CO4)C

InChI

InChI=1S/C21H16Br3N3O3S2/c1-10-11(2)32-19-17(10)20(29)27(8-13-4-3-5-30-13)21(26-19)31-9-16(28)25-18-14(23)6-12(22)7-15(18)24/h3-7H,8-9H2,1-2H3,(H,25,28)