2-[4-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-oxidanylidene-3-piperidin-1-yl-propyl]phenyl]guanidine

Systemtic Name: 2-[4-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-oxidanylidene-3-piperidin-1-yl-propyl]phenyl]guanidine Openeye Name: 2-[4-[2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-3-oxo-3-(1-piperidyl)propyl]phenyl]guanidine CAS Name: 2-[4-[2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-3-oxo-3-(1-piperidinyl)propyl]phenyl]guanidine IUPAC Name: 2-[4-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-oxo-3-piperidin-1-ylpropyl]phenyl]guanidine Traditional Name: 2-[4-[3-keto-2-(naphthionylamino)-3-piperidino-propyl]phenyl]guanidine Formula: C27H34N6O3S MolecularWeight: 522.66226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CC=C(C=C3)N=C(N)N)C(=O)N4CCCCC4

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CC=C(C=C3)N=C(N)N)C(=O)N4CCCCC4

InChI

InChI=1S/C27H34N6O3S/c1-32(2)24-10-6-9-22-21(24)8-7-11-25(22)37(35,36)31-23(26(34)33-16-4-3-5-17-33)18-19-12-14-20(15-13-19)30-27(28)29/h6-15,23,31H,3-5,16-18H2,1-2H3,(H4,28,29,30)