2-[4-[1-[(4-methylphenyl)sulfonylamino]-2-oxidanylidene-2-piperidin-1-yl-ethyl]phenyl]ethanimidamide

Systemtic Name: 2-[4-[1-[(4-methylphenyl)sulfonylamino]-2-oxidanylidene-2-piperidin-1-yl-ethyl]phenyl]ethanimidamide Openeye Name: 2-[4-[2-oxo-2-(1-piperidyl)-1-(p-tolylsulfonylamino)ethyl]phenyl]acetamidine CAS Name: 2-[4-[1-[(4-methylphenyl)sulfonylamino]-2-oxo-2-(1-piperidinyl)ethyl]phenyl]ethanimidamide IUPAC Name: 2-[4-[1-[(4-methylphenyl)sulfonylamino]-2-oxo-2-piperidin-1-ylethyl]phenyl]ethanimidamide Traditional Name: 2-[4-[2-keto-2-piperidino-1-(tosylamino)ethyl]phenyl]acetamidine Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=C(C=C2)CC(=N)N)C(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=C(C=C2)CC(=N)N)C(=O)N3CCCCC3

InChI

InChI=1S/C22H28N4O3S/c1-16-5-11-19(12-6-16)30(28,29)25-21(22(27)26-13-3-2-4-14-26)18-9-7-17(8-10-18)15-20(23)24/h5-12,21,25H,2-4,13-15H2,1H3,(H3,23,24)