N-(butylcarbamoyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(butylcarbamoyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(butylcarbamoyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-[butylamino(oxo)methyl]-2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(butylcarbamoyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(butylcarbamoyl)-2-[4-(3-nitrophenyl)sulfonylpiperazino]propionamide Formula: C18H27N5O6S MolecularWeight: 441.50188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)NC(=O)C(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H27N5O6S/c1-3-4-8-19-18(25)20-17(24)14(2)21-9-11-22(12-10-21)30(28,29)16-7-5-6-15(13-16)23(26)27/h5-7,13-14H,3-4,8-12H2,1-2H3,(H2,19,20,24,25)