N-[4-chloranyl-6-(5-chloranyl-2-methyl-phenyl)sulfanyl-pyrimidin-5-yl]-4-nitro-benzamide

Systemtic Name: N-[4-chloranyl-6-(5-chloranyl-2-methyl-phenyl)sulfanyl-pyrimidin-5-yl]-4-nitro-benzamide Openeye Name: N-[4-chloro-6-(5-chloro-2-methyl-phenyl)sulfanyl-pyrimidin-5-yl]-4-nitro-benzamide CAS Name: N-[4-chloro-6-[(5-chloro-2-methylphenyl)thio]-5-pyrimidinyl]-4-nitrobenzamide IUPAC Name: N-[4-chloro-6-(5-chloro-2-methylphenyl)sulfanylpyrimidin-5-yl]-4-nitrobenzamide Traditional Name: N-[4-chloro-6-[(5-chloro-2-methyl-phenyl)thio]pyrimidin-5-yl]-4-nitro-benzamide Formula: C18H12Cl2N4O3S MolecularWeight: 435.28388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)SC2=C(C(=NC=N2)Cl)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)SC2=C(C(=NC=N2)Cl)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H12Cl2N4O3S/c1-10-2-5-12(19)8-14(10)28-18-15(16(20)21-9-22-18)23-17(25)11-3-6-13(7-4-11)24(26)27/h2-9H,1H3,(H,23,25)