2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(4-nitrophenyl)phenyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(4-nitrophenyl)phenyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(4-nitrophenyl)phenyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[4-(4-nitrophenyl)phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(4-nitrophenyl)phenyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[4-(4-nitrophenyl)phenyl]acetamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N4O3S/c1-13-11-14(2)22-20(21-13)28-12-19(25)23-17-7-3-15(4-8-17)16-5-9-18(10-6-16)24(26)27/h3-11H,12H2,1-2H3,(H,23,25)