ethyl 6-methyl-2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-4-oxidanylidene-3H-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 6-methyl-2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 6-methyl-2-[[(1-methyl-2-benzimidazolyl)thio]methyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-keto-6-methyl-2-[[(1-methylbenzimidazol-2-yl)thio]methyl]-3H-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=O)NC(=N2)CSC3=NC4=CC=CC=C4N3C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=O)NC(=N2)CSC3=NC4=CC=CC=C4N3C)C

InChI

InChI=1S/C19H18N4O4S/c1-4-26-18(25)14-10(2)27-17-15(14)16(24)21-13(22-17)9-28-19-20-11-7-5-6-8-12(11)23(19)3/h5-8H,4,9H2,1-3H3,(H,21,22,24)