4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]-N-phenethyl-butanamide

Systemtic Name: 4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]-N-phenethyl-butanamide Openeye Name: 4-[4-oxo-2-(p-tolylmethylsulfanyl)thieno[3,2-d]pyrimidin-3-yl]-N-phenethyl-butanamide CAS Name: 4-[2-[(4-methylphenyl)methylthio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]-N-phenethylbutanamide IUPAC Name: 4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxothieno[3,2-d]pyrimidin-3-yl]-N-phenethylbutanamide Traditional Name: 4-[4-keto-2-[(4-methylbenzyl)thio]thieno[3,2-d]pyrimidin-3-yl]-N-phenethyl-butyramide Formula: C26H27N3O2S2 MolecularWeight: 477.64148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2CCCC(=O)NCCC4=CC=CC=C4)SC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2CCCC(=O)NCCC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C26H27N3O2S2/c1-19-9-11-21(12-10-19)18-33-26-28-22-14-17-32-24(22)25(31)29(26)16-5-8-23(30)27-15-13-20-6-3-2-4-7-20/h2-4,6-7,9-12,14,17H,5,8,13,15-16,18H2,1H3,(H,27,30)