1-(2-bromanyl-5-ethyl-phenyl)-1-methyl-2-(3-methylsulfanylphenyl)guanidine

Systemtic Name: 1-(2-bromanyl-5-ethyl-phenyl)-1-methyl-2-(3-methylsulfanylphenyl)guanidine Openeye Name: 1-(2-bromo-5-ethyl-phenyl)-1-methyl-2-(3-methylsulfanylphenyl)guanidine CAS Name: 1-(2-bromo-5-ethylphenyl)-1-methyl-2-[3-(methylthio)phenyl]guanidine IUPAC Name: 1-(2-bromo-5-ethylphenyl)-1-methyl-2-(3-methylsulfanylphenyl)guanidine Traditional Name: 1-(2-bromo-5-ethyl-phenyl)-1-methyl-2-[3-(methylthio)phenyl]guanidine Formula: C17H20BrN3S MolecularWeight: 378.3298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)Br)N(C)C(=NC2=CC(=CC=C2)SC)N

Isomeric SMILES

CCC1=CC(=C(C=C1)Br)N(C)C(=NC2=CC(=CC=C2)SC)N

InChI

InChI=1S/C17H20BrN3S/c1-4-12-8-9-15(18)16(10-12)21(2)17(19)20-13-6-5-7-14(11-13)22-3/h5-11H,4H2,1-3H3,(H2,19,20)