4-[[2,4-bis(oxidanylidene)-1H-thieno[3,2-d]pyrimidin-3-yl]methyl]-N-phenethyl-benzamide

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-1H-thieno[3,2-d]pyrimidin-3-yl]methyl]-N-phenethyl-benzamide Openeye Name: 4-[(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-benzamide CAS Name: 4-[(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethylbenzamide IUPAC Name: 4-[(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethylbenzamide Traditional Name: 4-[(2,4-diketo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-benzamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C22H19N3O3S/c26-20(23-12-10-15-4-2-1-3-5-15)17-8-6-16(7-9-17)14-25-21(27)19-18(11-13-29-19)24-22(25)28/h1-9,11,13H,10,12,14H2,(H,23,26)(H,24,28)