3-bromanyl-N-[2-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-bromo-N-[2-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: 3-bromo-N-[2-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 3-bromo-N-[2-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: 3-bromo-N-[2-keto-2-[4-(5-nitrothiophene-2-carbonyl)piperazino]ethyl]benzamide Formula: C18H17BrN4O5S MolecularWeight: 481.32038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC(=O)C2=CC(=CC=C2)Br)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CNC(=O)C2=CC(=CC=C2)Br)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C18H17BrN4O5S/c19-13-3-1-2-12(10-13)17(25)20-11-15(24)21-6-8-22(9-7-21)18(26)14-4-5-16(29-14)23(27)28/h1-5,10H,6-9,11H2,(H,20,25)