N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide

Systemtic Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC=C(O2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC=C(O2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-13-18(14(2)25-21(24-13)28-3)9-11-20(26)23-12-17-8-10-19(27-17)15-4-6-16(22)7-5-15/h4-8,10H,9,11-12H2,1-3H3,(H,23,26)