ethanedioic acid; 2-[(furan-2-ylmethylamino)methyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: ethanedioic acid; 2-[(furan-2-ylmethylamino)methyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(2-furylmethylamino)methyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one; oxalic acid CAS Name: 2-[(2-furanylmethylamino)methyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one; oxalic acid IUPAC Name: 2-[(furan-2-ylmethylamino)methyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one; oxalic acid Traditional Name: 2-[(2-furfurylamino)methyl]-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one; oxalic acid Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)CNCC3=CC=CO3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)CNCC3=CC=CO3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H17N3O2S.C2H2O4/c1-12-16(13-6-3-2-4-7-13)17-18(23)21-15(22-19(17)25-12)11-20-10-14-8-5-9-24-14;3-1(4)2(5)6/h2-9,20H,10-11H2,1H3,(H,21,22,23);(H,3,4)(H,5,6)