1-cyano-2-cyclohexyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-guanidine

Systemtic Name: 1-cyano-2-cyclohexyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-guanidine Openeye Name: 1-cyano-2-cyclohexyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-guanidine CAS Name: 1-cyano-2-cyclohexyl-3-[2-(cyclohexylamino)-5-nitrophenyl]sulfonylguanidine IUPAC Name: 1-cyano-2-cyclohexyl-3-[2-(cyclohexylamino)-5-nitrophenyl]sulfonylguanidine Traditional Name: 1-cyano-2-cyclohexyl-3-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-guanidine Formula: C20H28N6O4S MolecularWeight: 448.53912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC(=NC3CCCCC3)NC#N

Isomeric SMILES

C1CCC(CC1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC(=NC3CCCCC3)NC#N

InChI

InChI=1S/C20H28N6O4S/c21-14-22-20(24-16-9-5-2-6-10-16)25-31(29,30)19-13-17(26(27)28)11-12-18(19)23-15-7-3-1-4-8-15/h11-13,15-16,23H,1-10H2,(H2,22,24,25)