N-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-N'-pyridin-2-yl-ethane-1,2-diamine

Systemtic Name: N-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-N'-pyridin-2-yl-ethane-1,2-diamine Openeye Name: N-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-N'-(2-pyridyl)ethane-1,2-diamine CAS Name: N-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-N'-(2-pyridinyl)ethane-1,2-diamine IUPAC Name: N-(2-nitro-4-piperidin-1-ylsulfonylphenyl)-N'-pyridin-2-ylethane-1,2-diamine Traditional Name: 2-(2-nitro-4-piperidinosulfonyl-anilino)ethyl-(2-pyridyl)amine Formula: C18H23N5O4S MolecularWeight: 405.47132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCNC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCNC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O4S/c24-23(25)17-14-15(28(26,27)22-12-4-1-5-13-22)7-8-16(17)19-10-11-21-18-6-2-3-9-20-18/h2-3,6-9,14,19H,1,4-5,10-13H2,(H,20,21)