4-[3-[2-[2-(butylsulfonylamino)-3-oxidanyl-propanoyl]cyclobutyl]propyl]benzenecarboximidamide

Systemtic Name: 4-[3-[2-[2-(butylsulfonylamino)-3-oxidanyl-propanoyl]cyclobutyl]propyl]benzenecarboximidamide Openeye Name: 4-[3-[2-[2-(butylsulfonylamino)-3-hydroxy-propanoyl]cyclobutyl]propyl]benzamidine CAS Name: 4-[3-[2-[2-(butylsulfonylamino)-3-hydroxy-1-oxopropyl]cyclobutyl]propyl]benzenecarboximidamide IUPAC Name: 4-[3-[2-[2-(butylsulfonylamino)-3-hydroxypropanoyl]cyclobutyl]propyl]benzenecarboximidamide Traditional Name: 4-[3-[2-[2-(butylsulfonylamino)-3-hydroxy-propanoyl]cyclobutyl]propyl]benzamidine Formula: C21H33N3O4S MolecularWeight: 423.56942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CO)C(=O)C1CCC1CCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCCCS(=O)(=O)NC(CO)C(=O)C1CCC1CCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H33N3O4S/c1-2-3-13-29(27,28)24-19(14-25)20(26)18-12-11-16(18)6-4-5-15-7-9-17(10-8-15)21(22)23/h7-10,16,18-19,24-25H,2-6,11-14H2,1H3,(H3,22,23)