4-(acetamidomethyl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide

Systemtic Name: 4-(acetamidomethyl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide Openeye Name: 4-(acetamidomethyl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide CAS Name: 4-(acetamidomethyl)-N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]benzamide IUPAC Name: 4-(acetamidomethyl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzamide Traditional Name: 4-(acetamidomethyl)-N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]benzamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S/c1-14-12-15(2)25-22(24-14)29-20-10-8-19(9-11-20)26-21(28)18-6-4-17(5-7-18)13-23-16(3)27/h4-12H,13H2,1-3H3,(H,23,27)(H,26,28)