N-(4-methoxyphenyl)-4-[(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)methyl]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)methyl]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[(4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]benzamide CAS Name: N-(4-methoxyphenyl)-4-[(4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[(4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]benzamide Traditional Name: 4-[(4-ketothieno[2,3-d]pyrimidin-3-yl)methyl]-N-(4-methoxyphenyl)benzamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C21H17N3O3S/c1-27-17-8-6-16(7-9-17)23-19(25)15-4-2-14(3-5-15)12-24-13-22-20-18(21(24)26)10-11-28-20/h2-11,13H,12H2,1H3,(H,23,25)