N-[(2-chlorophenyl)methyl]-5-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-5-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanamide Openeye Name: N-[(2-chlorophenyl)methyl]-5-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)pentanamide CAS Name: N-[(2-chlorophenyl)methyl]-5-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-5-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanamide Traditional Name: N-(2-chlorobenzyl)-5-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)valeramide Formula: C18H18ClN3O2S2 MolecularWeight: 407.93742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCCCN2C(=O)C3=C(C=CS3)NC2=S)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCCCN2C(=O)C3=C(C=CS3)NC2=S)Cl

InChI

InChI=1S/C18H18ClN3O2S2/c19-13-6-2-1-5-12(13)11-20-15(23)7-3-4-9-22-17(24)16-14(8-10-26-16)21-18(22)25/h1-2,5-6,8,10H,3-4,7,9,11H2,(H,20,23)(H,21,25)