1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-propan-2-yl-urea

Systemtic Name: 1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-propan-2-yl-urea Openeye Name: 1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-isopropyl-urea CAS Name: 1-[2-(cycloheptylamino)-5-nitrophenyl]sulfonyl-3-propan-2-ylurea IUPAC Name: 1-[2-(cycloheptylamino)-5-nitrophenyl]sulfonyl-3-propan-2-ylurea Traditional Name: 1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-isopropyl-urea Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCCC2

Isomeric SMILES

CC(C)NC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCCC2

InChI

InChI=1S/C17H26N4O5S/c1-12(2)18-17(22)20-27(25,26)16-11-14(21(23)24)9-10-15(16)19-13-7-5-3-4-6-8-13/h9-13,19H,3-8H2,1-2H3,(H2,18,20,22)