1-tert-butyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-urea

Systemtic Name: 1-tert-butyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-urea Openeye Name: 1-tert-butyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-urea CAS Name: 1-tert-butyl-3-[2-(cyclohexylamino)-5-nitrophenyl]sulfonylurea IUPAC Name: 1-tert-butyl-3-[2-(cyclohexylamino)-5-nitrophenyl]sulfonylurea Traditional Name: 1-tert-butyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-urea Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2

Isomeric SMILES

CC(C)(C)NC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2

InChI

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