2-[(4-oxidanylidene-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(4-oxidanylidene-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-(4-oxo-3-phenethyl-benzothiopheno[3,2-d]pyrimidin-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(4-oxo-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(4-oxo-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(4-keto-3-phenethyl-benzothiopheno[3,2-d]pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C28H25N3O2S2 MolecularWeight: 499.647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC5=CC=CC=C53

InChI

InChI=1S/C28H25N3O2S2/c32-24(29-17-15-20-9-3-1-4-10-20)19-34-28-30-25-22-13-7-8-14-23(22)35-26(25)27(33)31(28)18-16-21-11-5-2-6-12-21/h1-14H,15-19H2,(H,29,32)