5-bromanyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-[3-(2-furylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-[3-[(2-furanylmethylamino)-oxomethyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-[3-(2-furfurylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C19H17BrN4O3S2 MolecularWeight: 493.39728

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NCC4=CC=CO4)Br

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NCC4=CC=CO4)Br

InChI

InChI=1S/C19H17BrN4O3S2/c1-28-19-22-9-12(20)15(23-19)17(26)24-18-14(11-5-2-6-13(11)29-18)16(25)21-8-10-4-3-7-27-10/h3-4,7,9H,2,5-6,8H2,1H3,(H,21,25)(H,24,26)