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

Systemtic Name: 2-[4-(5-bromanyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-(5-bromo-3,4-dimethyl-2-thieno[2,3-b]thiophenyl)-2-pyrimidinyl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[4-(5-bromo-3,4-dimethylthieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]sulfanyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[4-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidin-2-yl]thio]acetamide Formula: C17H16BrN3OS3 MolecularWeight: 454.42744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=C(S2)Br)C)C3=NC(=NC=C3)SCC(=O)NCC=C

Isomeric SMILES

CC1=C(SC2=C1C(=C(S2)Br)C)C3=NC(=NC=C3)SCC(=O)NCC=C

InChI

InChI=1S/C17H16BrN3OS3/c1-4-6-19-12(22)8-23-17-20-7-5-11(21-17)14-9(2)13-10(3)15(18)25-16(13)24-14/h4-5,7H,1,6,8H2,2-3H3,(H,19,22)