2-[3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoylamino]-N-phenethyl-benzamide CAS Name: 2-[[1-oxo-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoylamino]-N-phenethylbenzamide Traditional Name: 2-[3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propanoylamino]-N-phenethyl-benzamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)CCN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)CCN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C24H22N4O3S/c29-21(11-14-28-16-26-23-19(24(28)31)12-15-32-23)27-20-9-5-4-8-18(20)22(30)25-13-10-17-6-2-1-3-7-17/h1-9,12,15-16H,10-11,13-14H2,(H,25,30)(H,27,29)