2-[4-[2-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-3-piperidin-1-yl-propyl]phenyl]guanidine

Systemtic Name: 2-[4-[2-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-3-piperidin-1-yl-propyl]phenyl]guanidine Openeye Name: 2-[4-[3-oxo-3-(1-piperidyl)-2-(p-tolylsulfonylamino)propyl]phenyl]guanidine CAS Name: 2-[4-[2-[(4-methylphenyl)sulfonylamino]-3-oxo-3-(1-piperidinyl)propyl]phenyl]guanidine IUPAC Name: 2-[4-[2-[(4-methylphenyl)sulfonylamino]-3-oxo-3-piperidin-1-ylpropyl]phenyl]guanidine Traditional Name: 2-[4-[3-keto-3-piperidino-2-(tosylamino)propyl]phenyl]guanidine Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)N=C(N)N)C(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)N=C(N)N)C(=O)N3CCCCC3

InChI

InChI=1S/C22H29N5O3S/c1-16-5-11-19(12-6-16)31(29,30)26-20(21(28)27-13-3-2-4-14-27)15-17-7-9-18(10-8-17)25-22(23)24/h5-12,20,26H,2-4,13-15H2,1H3,(H4,23,24,25)