4-(2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoyl)-N'-[(4-methylsulfonylphenyl)methyl]piperazine-1-carboximidamide

Systemtic Name: 4-(2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoyl)-N'-[(4-methylsulfonylphenyl)methyl]piperazine-1-carboximidamide Openeye Name: 4-(2-cyclopentyl-2-hydroxy-2-phenyl-acetyl)-N'-[(4-methylsulfonylphenyl)methyl]piperazine-1-carboxamidine CAS Name: 4-(2-cyclopentyl-2-hydroxy-1-oxo-2-phenylethyl)-N'-[(4-methylsulfonylphenyl)methyl]-1-piperazinecarboximidamide IUPAC Name: 4-(2-cyclopentyl-2-hydroxy-2-phenylacetyl)-N'-[(4-methylsulfonylphenyl)methyl]piperazine-1-carboximidamide Traditional Name: 4-(2-cyclopentyl-2-hydroxy-2-phenyl-acetyl)-N'-(4-mesylbenzyl)piperazine-1-carboxamidine Formula: C26H34N4O4S MolecularWeight: 498.63756

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN=C(N)N2CCN(CC2)C(=O)C(C3CCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN=C(N)N2CCN(CC2)C(=O)C(C3CCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C26H34N4O4S/c1-35(33,34)23-13-11-20(12-14-23)19-28-25(27)30-17-15-29(16-18-30)24(31)26(32,22-9-5-6-10-22)21-7-3-2-4-8-21/h2-4,7-8,11-14,22,32H,5-6,9-10,15-19H2,1H3,(H2,27,28)