4-(cyclopropylamino)-3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-(cyclopropylamino)-3-nitro-N-[3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(cyclopropylamino)-3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-(cyclopropylamino)-3-nitro-N-(3-piperidinosulfonylphenyl)benzamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5S/c26-21(15-7-10-19(22-16-8-9-16)20(13-15)25(27)28)23-17-5-4-6-18(14-17)31(29,30)24-11-2-1-3-12-24/h4-7,10,13-14,16,22H,1-3,8-9,11-12H2,(H,23,26)