(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl naphthalene-2-carboxylate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl naphthalene-2-carboxylate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C18H12N2O3S MolecularWeight: 336.36448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C18H12N2O3S/c21-17-16-14(7-8-24-16)19-15(20-17)10-23-18(22)13-6-5-11-3-1-2-4-12(11)9-13/h1-9H,10H2,(H,19,20,21)