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

Systemtic Name: 2-[4-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-oxidanylidene-3-piperidin-1-yl-propyl]phenyl]guanidine Openeye Name: 2-[4-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-oxo-3-(1-piperidyl)propyl]phenyl]guanidine CAS Name: 2-[4-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-oxo-3-(1-piperidinyl)propyl]phenyl]guanidine IUPAC Name: 2-[4-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-oxo-3-piperidin-1-ylpropyl]phenyl]guanidine Traditional Name: 2-[4-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-keto-3-piperidino-propyl]phenyl]guanidine Formula: C25H35N5O3S MolecularWeight: 485.6421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=C(C=C2)N=C(N)N)C(=O)N3CCCCC3

InChI

InChI=1S/C25H35N5O3S/c1-25(2,3)19-9-13-21(14-10-19)34(32,33)29-22(23(31)30-15-5-4-6-16-30)17-18-7-11-20(12-8-18)28-24(26)27/h7-14,22,29H,4-6,15-17H2,1-3H3,(H4,26,27,28)/t22-/m0/s1