N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(4-methoxyphenyl)propanamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(4-methoxyphenyl)propanamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3-(4-methoxyphenyl)propanamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-3-(4-methoxyphenyl)propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CCC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CCC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H23N3O2S/c1-15-14-16(2)24-22(23-15)28-20-11-7-18(8-12-20)25-21(26)13-6-17-4-9-19(27-3)10-5-17/h4-5,7-12,14H,6,13H2,1-3H3,(H,25,26)