3-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide

Systemtic Name: 3-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Openeye Name: 3-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide CAS Name: 3-[(6-phenyl-4-pyrimidinyl)thio]-N-(2,4,6-trimethylphenyl)propanamide IUPAC Name: 3-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Traditional Name: N-mesityl-3-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCSC2=NC=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCSC2=NC=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3OS/c1-15-11-16(2)22(17(3)12-15)25-20(26)9-10-27-21-13-19(23-14-24-21)18-7-5-4-6-8-18/h4-8,11-14H,9-10H2,1-3H3,(H,25,26)