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

Systemtic Name: N,N-bis(2-cyanoethyl)-2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N,N-bis(2-cyanoethyl)-2-(5-cyclopropyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N,N-bis(2-cyanoethyl)-2-[(5-cyclopropyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-(5-cyclopropyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N,N-bis(2-cyanoethyl)-2-[(5-cyclopropyl-4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C23H21N5O2S2 MolecularWeight: 463.57514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N(CCC#N)CCC#N)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N(CCC#N)CCC#N)C4=CC=CC=C4

InChI

InChI=1S/C23H21N5O2S2/c24-10-4-12-27(13-5-11-25)19(29)15-32-23-26-21-20(18(14-31-21)16-8-9-16)22(30)28(23)17-6-2-1-3-7-17/h1-3,6-7,14,16H,4-5,8-9,12-13,15H2