2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[5-(4-chlorophenyl)-4-thieno[2,3-d]pyrimidinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]thio]-N-phenethyl-acetamide Formula: C22H18ClN3OS2 MolecularWeight: 439.98082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC=NC3=C2C(=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3OS2/c23-17-8-6-16(7-9-17)18-12-28-21-20(18)22(26-14-25-21)29-13-19(27)24-11-10-15-4-2-1-3-5-15/h1-9,12,14H,10-11,13H2,(H,24,27)