2-[6-azanyl-1-(4-chlorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-bromanyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[6-azanyl-1-(4-chlorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-bromanyl-4-nitro-phenyl)ethanamide Openeye Name: 2-[6-amino-1-(4-chlorophenyl)-4-oxo-pyrimidin-2-yl]sulfanyl-N-(2-bromo-4-nitro-phenyl)acetamide CAS Name: 2-[[6-amino-1-(4-chlorophenyl)-4-oxo-2-pyrimidinyl]thio]-N-(2-bromo-4-nitrophenyl)acetamide IUPAC Name: 2-[6-amino-1-(4-chlorophenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-(2-bromo-4-nitrophenyl)acetamide Traditional Name: 2-[[6-amino-1-(4-chlorophenyl)-4-keto-pyrimidin-2-yl]thio]-N-(2-bromo-4-nitro-phenyl)acetamide Formula: C18H13BrClN5O4S MolecularWeight: 510.74892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)N)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)N)Cl

InChI

InChI=1S/C18H13BrClN5O4S/c19-13-7-12(25(28)29)5-6-14(13)22-17(27)9-30-18-23-16(26)8-15(21)24(18)11-3-1-10(20)2-4-11/h1-8H,9,21H2,(H,22,27)