1-cyano-3-[4-(cyclohexylamino)pyridin-3-yl]sulfonyl-2-cyclooctyl-guanidine

Systemtic Name: 1-cyano-3-[4-(cyclohexylamino)pyridin-3-yl]sulfonyl-2-cyclooctyl-guanidine Openeye Name: 1-cyano-3-[[4-(cyclohexylamino)-3-pyridyl]sulfonyl]-2-cyclooctyl-guanidine CAS Name: 1-cyano-3-[[4-(cyclohexylamino)-3-pyridinyl]sulfonyl]-2-cyclooctylguanidine IUPAC Name: 1-cyano-3-[4-(cyclohexylamino)pyridin-3-yl]sulfonyl-2-cyclooctylguanidine Traditional Name: 1-cyano-3-[[4-(cyclohexylamino)-3-pyridyl]sulfonyl]-2-cyclooctyl-guanidine Formula: C21H32N6O2S MolecularWeight: 432.58278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N=C(NC#N)NS(=O)(=O)C2=C(C=CN=C2)NC3CCCCC3

Isomeric SMILES

C1CCCC(CCC1)N=C(NC#N)NS(=O)(=O)C2=C(C=CN=C2)NC3CCCCC3

InChI

InChI=1S/C21H32N6O2S/c22-16-24-21(26-18-11-5-2-1-3-6-12-18)27-30(28,29)20-15-23-14-13-19(20)25-17-9-7-4-8-10-17/h13-15,17-18H,1-12H2,(H,23,25)(H2,24,26,27)