N-[(5-methylthiophen-2-yl)methyl]-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-phenethyl-ethanamide

Systemtic Name: N-[(5-methylthiophen-2-yl)methyl]-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-phenethyl-ethanamide Openeye Name: N-[(5-methyl-2-thienyl)methyl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-phenethyl-acetamide CAS Name: N-[(5-methyl-2-thiophenyl)methyl]-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-phenethylacetamide IUPAC Name: N-[(5-methylthiophen-2-yl)methyl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-phenethylacetamide Traditional Name: 2-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-acetamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C22H21N3O2S2/c1-16-7-8-18(29-16)13-24(11-9-17-5-3-2-4-6-17)20(26)14-25-15-23-21-19(22(25)27)10-12-28-21/h2-8,10,12,15H,9,11,13-14H2,1H3