2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(4-methoxy-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(4-methoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(4-methoxy-2-nitro-phenyl)acetamide CAS Name: 2-[[4-(4-bromophenyl)-2-pyrimidinyl]thio]-N-(4-methoxy-2-nitrophenyl)acetamide IUPAC Name: 2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(4-methoxy-2-nitrophenyl)acetamide Traditional Name: 2-[[4-(4-bromophenyl)pyrimidin-2-yl]thio]-N-(4-methoxy-2-nitro-phenyl)acetamide Formula: C19H15BrN4O4S MolecularWeight: 475.3158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=N2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=N2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H15BrN4O4S/c1-28-14-6-7-16(17(10-14)24(26)27)22-18(25)11-29-19-21-9-8-15(23-19)12-2-4-13(20)5-3-12/h2-10H,11H2,1H3,(H,22,25)