N-[(2-chlorophenyl)methyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)hexanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)hexanamide Openeye Name: N-[(2-chlorophenyl)methyl]-6-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)hexanamide CAS Name: N-[(2-chlorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)hexanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)hexanamide Traditional Name: N-(2-chlorobenzyl)-6-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)hexanamide Formula: C19H20ClN3O2S2 MolecularWeight: 421.964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCCCCN2C(=O)C3=C(C=CS3)NC2=S)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCCCCN2C(=O)C3=C(C=CS3)NC2=S)Cl

InChI

InChI=1S/C19H20ClN3O2S2/c20-14-7-4-3-6-13(14)12-21-16(24)8-2-1-5-10-23-18(25)17-15(9-11-27-17)22-19(23)26/h3-4,6-7,9,11H,1-2,5,8,10,12H2,(H,21,24)(H,22,26)