1-cyano-2-(2-methylbutan-2-yl)-3-(4-piperidin-1-ylsulfonylphenyl)guanidine

Systemtic Name: 1-cyano-2-(2-methylbutan-2-yl)-3-(4-piperidin-1-ylsulfonylphenyl)guanidine Openeye Name: 1-cyano-2-(1,1-dimethylpropyl)-3-[4-(1-piperidylsulfonyl)phenyl]guanidine CAS Name: 1-cyano-2-(2-methylbutan-2-yl)-3-[4-(1-piperidinylsulfonyl)phenyl]guanidine IUPAC Name: 1-cyano-2-(2-methylbutan-2-yl)-3-(4-piperidin-1-ylsulfonylphenyl)guanidine Traditional Name: 2-tert-amyl-1-cyano-3-(4-piperidinosulfonylphenyl)guanidine Formula: C18H27N5O2S MolecularWeight: 377.50428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N=C(NC#N)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCC(C)(C)N=C(NC#N)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H27N5O2S/c1-4-18(2,3)22-17(20-14-19)21-15-8-10-16(11-9-15)26(24,25)23-12-6-5-7-13-23/h8-11H,4-7,12-13H2,1-3H3,(H2,20,21,22)