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

Systemtic Name: 2-[4-[(5-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(5-nitrobenzothiophene-2-carbonyl)piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-(5-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-(5-nitrobenzothiophene-2-carbonyl)piperazino]-N-propyl-acetamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O4S/c1-2-5-19-17(23)12-20-6-8-21(9-7-20)18(24)16-11-13-10-14(22(25)26)3-4-15(13)27-16/h3-4,10-11H,2,5-9,12H2,1H3,(H,19,23)