4-[2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide

Systemtic Name: 4-[2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide Openeye Name: 4-[2-(5-cyclopropyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide CAS Name: 4-[[2-[(5-cyclopropyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[2-(5-cyclopropyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoylamino]benzamide Traditional Name: 4-[2-[(5-cyclopropyl-4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propanoylamino]benzamide Formula: C25H22N4O3S2 MolecularWeight: 490.59718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NC3=C(C(=CS3)C4CC4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NC3=C(C(=CS3)C4CC4)C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O3S2/c1-14(22(31)27-17-11-9-16(10-12-17)21(26)30)34-25-28-23-20(19(13-33-23)15-7-8-15)24(32)29(25)18-5-3-2-4-6-18/h2-6,9-15H,7-8H2,1H3,(H2,26,30)(H,27,31)