N-butyl-2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butyl-2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-butyl-2-[3-[(2-chlorophenyl)methyl]-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-butyl-2-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]acetamide IUPAC Name: N-butyl-2-[3-[(2-chlorophenyl)methyl]-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-butyl-2-[[3-(2-chlorobenzyl)-4-keto-thieno[3,2-d]pyrimidin-2-yl]thio]acetamide Formula: C19H20ClN3O2S2 MolecularWeight: 421.964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CC=C3Cl)SC=C2

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CC=C3Cl)SC=C2

InChI

InChI=1S/C19H20ClN3O2S2/c1-2-3-9-21-16(24)12-27-19-22-15-8-10-26-17(15)18(25)23(19)11-13-6-4-5-7-14(13)20/h4-8,10H,2-3,9,11-12H2,1H3,(H,21,24)