3-[3-(4-butylsulfonylpiperazin-1-yl)-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 3-[3-(4-butylsulfonylpiperazin-1-yl)-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 3-[3-(4-butylsulfonylpiperazin-1-yl)-3-oxo-propyl]benzamidine CAS Name: 3-[3-(4-butylsulfonyl-1-piperazinyl)-3-oxopropyl]benzenecarboximidamide IUPAC Name: 3-[3-(4-butylsulfonylpiperazin-1-yl)-3-oxopropyl]benzenecarboximidamide Traditional Name: 3-[3-(4-butylsulfonylpiperazino)-3-keto-propyl]benzamidine Formula: C18H28N4O3S MolecularWeight: 380.50492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCN(CC1)C(=O)CCC2=CC=CC(=C2)C(=N)N

Isomeric SMILES

CCCCS(=O)(=O)N1CCN(CC1)C(=O)CCC2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C18H28N4O3S/c1-2-3-13-26(24,25)22-11-9-21(10-12-22)17(23)8-7-15-5-4-6-16(14-15)18(19)20/h4-6,14H,2-3,7-13H2,1H3,(H3,19,20)