(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-imidazol-1-yl)methyl-methyl-[(4-morpholin-4-ylphenyl)methyl]azanium

Systemtic Name: (3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-imidazol-1-yl)methyl-methyl-[(4-morpholin-4-ylphenyl)methyl]azanium Openeye Name: (3-cyclopentyl-4,5-dimethyl-2-thioxo-imidazol-1-yl)methyl-methyl-[(4-morpholinophenyl)methyl]ammonium CAS Name: (3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-1-imidazolyl)methyl-methyl-[[4-(4-morpholinyl)phenyl]methyl]ammonium IUPAC Name: (3-cyclopentyl-4,5-dimethyl-2-sulfanylideneimidazol-1-yl)methyl-methyl-[(4-morpholin-4-ylphenyl)methyl]azanium Traditional Name: (3-cyclopentyl-4,5-dimethyl-2-thioxo-4-imidazolin-1-yl)methyl-methyl-(4-morpholinobenzyl)ammonium Formula: C23H35N4OS+ MolecularWeight: 415.6152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N1C[NH+](C)CC2=CC=C(C=C2)N3CCOCC3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=S)N1C[NH+](C)CC2=CC=C(C=C2)N3CCOCC3)C4CCCC4)C

InChI

InChI=1S/C23H34N4OS/c1-18-19(2)27(22-6-4-5-7-22)23(29)26(18)17-24(3)16-20-8-10-21(11-9-20)25-12-14-28-15-13-25/h8-11,22H,4-7,12-17H2,1-3H3/p+1