2-[2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylethanoyl-methyl-amino]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 2-[2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylethanoyl-methyl-amino]-N-(furan-2-ylmethyl)benzamide Openeye Name: 2-[[2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]-methyl-amino]-N-(2-furylmethyl)benzamide CAS Name: 2-[[2-[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]-methylamino]-N-(2-furanylmethyl)benzamide IUPAC Name: 2-[[2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]-methylamino]-N-(furan-2-ylmethyl)benzamide Traditional Name: 2-[[2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]acetyl]-methyl-amino]-N-(2-furfuryl)benzamide Formula: C21H19N5O3S2 MolecularWeight: 453.53726

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)C(=O)CSC3=NC(=C4C=CSC4=N3)N

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)C(=O)CSC3=NC(=C4C=CSC4=N3)N

InChI

InChI=1S/C21H19N5O3S2/c1-26(17(27)12-31-21-24-18(22)15-8-10-30-20(15)25-21)16-7-3-2-6-14(16)19(28)23-11-13-5-4-9-29-13/h2-10H,11-12H2,1H3,(H,23,28)(H2,22,24,25)