(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl-methyl-[(1S)-tetralin-1-yl]ammonium CAS Name: [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]ammonium IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Traditional Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl-methyl-[(1S)-tetralin-1-yl]ammonium Formula: C25H33N4O3S+ MolecularWeight: 469.61952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](C)C4CCCC5=CC=CC=C45

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](C)[C@H]4CCCC5=CC=CC=C45

InChI

InChI=1S/C25H32N4O3S/c1-3-29-24-12-11-20(33(30,31)28-13-15-32-16-14-28)17-22(24)26-25(29)18-27(2)23-10-6-8-19-7-4-5-9-21(19)23/h4-5,7,9,11-12,17,23H,3,6,8,10,13-16,18H2,1-2H3/p+1/t23-/m0/s1