N-(2-aminophenyl)-4-[(4,6-dimethylpyrimidin-2-yl)-sulfanyl-methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[(4,6-dimethylpyrimidin-2-yl)-sulfanyl-methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[(4,6-dimethylpyrimidin-2-yl)-sulfanyl-methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[(4,6-dimethyl-2-pyrimidinyl)-mercaptomethyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[(4,6-dimethylpyrimidin-2-yl)-sulfanylmethyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[(4,6-dimethylpyrimidin-2-yl)-mercapto-methyl]benzamide Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)S)C

Isomeric SMILES

CC1=CC(=NC(=N1)C(C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)S)C

InChI

InChI=1S/C20H20N4OS/c1-12-11-13(2)23-19(22-12)18(26)14-7-9-15(10-8-14)20(25)24-17-6-4-3-5-16(17)21/h3-11,18,26H,21H2,1-2H3,(H,24,25)