N,N-dimethyl-2-[4-[(5-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-[(5-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-(5-nitrobenzothiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(5-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-(5-nitrobenzothiophene-2-carbonyl)piperazino]acetamide Formula: C17H20N4O4S MolecularWeight: 376.4301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCN(CC1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CN1CCN(CC1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c1-18(2)16(22)11-19-5-7-20(8-6-19)17(23)15-10-12-9-13(21(24)25)3-4-14(12)26-15/h3-4,9-10H,5-8,11H2,1-2H3