N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: N-(5-cyclopropyl-2-phenyl-3-pyrazolyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(5-cyclopropyl-2-phenylpyrazol-3-yl)-2-(4-oxo-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C23H21N5O2S2 MolecularWeight: 463.57514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=CC(=NN3C4=CC=CC=C4)C5CC5

Isomeric SMILES

C=CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=CC(=NN3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C23H21N5O2S2/c1-2-11-27-22(30)21-17(10-12-31-21)24-23(27)32-14-20(29)25-19-13-18(15-8-9-15)26-28(19)16-6-4-3-5-7-16/h2-7,10,12-13,15H,1,8-9,11,14H2,(H,25,29)