1-(2-methylquinolin-4-yl)-2-octadecyl-3-(1,3-thiazol-2-yl)guanidine dihydrochloride

Systemtic Name: 1-(2-methylquinolin-4-yl)-2-octadecyl-3-(1,3-thiazol-2-yl)guanidine dihydrochloride Openeye Name: 1-(2-methyl-4-quinolyl)-2-octadecyl-3-thiazol-2-yl-guanidine dihydrochloride CAS Name: 1-(2-methyl-4-quinolinyl)-2-octadecyl-3-(2-thiazolyl)guanidine dihydrochloride IUPAC Name: 1-(2-methylquinolin-4-yl)-2-octadecyl-3-(1,3-thiazol-2-yl)guanidine dihydrochloride Traditional Name: 1-(2-methyl-4-quinolyl)-2-stearyl-3-thiazol-2-yl-guanidine dihydrochloride Formula: C32H51Cl2N5S MolecularWeight: 608.75184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN=C(NC1=CC(=NC2=CC=CC=C21)C)NC3=NC=CS3.Cl.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN=C(NC1=CC(=NC2=CC=CC=C21)C)NC3=NC=CS3.Cl.Cl

InChI

InChI=1S/C32H49N5S.2ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-33-31(37-32-34-24-25-38-32)36-30-26-27(2)35-29-22-19-18-21-28(29)30;;/h18-19,21-22,24-26H,3-17,20,23H2,1-2H3,(H2,33,34,35,36,37);2*1H