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

Systemtic Name: N-[2-(3-chloranylphenoxy)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[2-(3-chlorophenoxy)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[2-(3-chlorophenoxy)ethyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[2-(3-chlorophenoxy)ethyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[2-(3-chlorophenoxy)ethyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C18H22ClN3O2S MolecularWeight: 379.90418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCOC2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCOC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H22ClN3O2S/c1-12-16(13(2)22-18(21-12)25-3)7-8-17(23)20-9-10-24-15-6-4-5-14(19)11-15/h4-6,11H,7-10H2,1-3H3,(H,20,23)