N2'-[3-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-4-piperidin-1-yl-butyl]ethanediimidamide

Systemtic Name: N2'-[3-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-4-piperidin-1-yl-butyl]ethanediimidamide Openeye Name: N2'-[4-oxo-4-(1-piperidyl)-3-(p-tolylsulfonylamino)butyl]oxalamidine CAS Name: N2'-[3-[(4-methylphenyl)sulfonylamino]-4-oxo-4-(1-piperidinyl)butyl]ethanediimidamide IUPAC Name: 2-N'-[3-[(4-methylphenyl)sulfonylamino]-4-oxo-4-piperidin-1-ylbutyl]ethanediimidamide Traditional Name: N2'-[4-keto-4-piperidino-3-(tosylamino)butyl]oxalamidine Formula: C18H28N6O3S MolecularWeight: 408.51832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCN=C(C(=N)N)N)C(=O)N2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCN=C(C(=N)N)N)C(=O)N2CCCCC2

InChI

InChI=1S/C18H28N6O3S/c1-13-5-7-14(8-6-13)28(26,27)23-15(9-10-22-17(21)16(19)20)18(25)24-11-3-2-4-12-24/h5-8,15,23H,2-4,9-12H2,1H3,(H3,19,20)(H2,21,22)