N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-[4-(2-furylmethylcarbamoylamino)phenyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[4-[[(2-furanylmethylamino)-oxomethyl]amino]phenyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-[4-(2-furfurylcarbamoylamino)phenyl]-3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C21H19N5O4S MolecularWeight: 437.47166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)NC2=CC=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1=COC(=C1)CNC(=O)NC2=CC=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C21H19N5O4S/c27-18(7-9-26-13-23-19-17(20(26)28)8-11-31-19)24-14-3-5-15(6-4-14)25-21(29)22-12-16-2-1-10-30-16/h1-6,8,10-11,13H,7,9,12H2,(H,24,27)(H2,22,25,29)