4-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]benzamide

Systemtic Name: 4-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]benzamide Openeye Name: 4-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]benzamide CAS Name: 4-[[1-oxo-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]propyl]amino]benzamide IUPAC Name: 4-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]benzamide Traditional Name: 4-[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]propanoylamino]benzamide Formula: C22H18N4O2S2 MolecularWeight: 434.53392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NC=NC3=C2C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O2S2/c1-13(20(28)26-16-9-7-15(8-10-16)19(23)27)30-22-18-17(14-5-3-2-4-6-14)11-29-21(18)24-12-25-22/h2-13H,1H3,(H2,23,27)(H,26,28)