3-[3-oxidanylidene-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propyl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propyl]benzenecarboximidamide Openeye Name: 3-[3-oxo-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propyl]benzamidine CAS Name: 3-[3-oxo-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]propyl]benzenecarboximidamide IUPAC Name: 3-[3-oxo-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propyl]benzenecarboximidamide Traditional Name: 3-[3-keto-3-(4-mesitylsulfonylpiperazino)propyl]benzamidine Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=CC(=C3)C(=N)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=CC(=C3)C(=N)N)C

InChI

InChI=1S/C23H30N4O3S/c1-16-13-17(2)22(18(3)14-16)31(29,30)27-11-9-26(10-12-27)21(28)8-7-19-5-4-6-20(15-19)23(24)25/h4-6,13-15H,7-12H2,1-3H3,(H3,24,25)