2-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-N-ethyl-benzamide

Systemtic Name: 2-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-N-ethyl-benzamide Openeye Name: 2-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoylamino]-N-ethyl-benzamide CAS Name: 2-[[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]amino]-N-ethylbenzamide IUPAC Name: 2-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoylamino]-N-ethylbenzamide Traditional Name: 2-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoylamino]-N-ethyl-benzamide Formula: C19H24N4O2S MolecularWeight: 372.48446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=CC=C1NC(=O)CCC2=C(N=C(N=C2C)SC)C

Isomeric SMILES

CCNC(=O)C1=CC=CC=C1NC(=O)CCC2=C(N=C(N=C2C)SC)C

InChI

InChI=1S/C19H24N4O2S/c1-5-20-18(25)15-8-6-7-9-16(15)23-17(24)11-10-14-12(2)21-19(26-4)22-13(14)3/h6-9H,5,10-11H2,1-4H3,(H,20,25)(H,23,24)