methyl 3-[2-[(N'-methylcarbamimidoyl)amino]-1,3-thiazol-4-yl]benzoate

Systemtic Name: methyl 3-[2-[(N'-methylcarbamimidoyl)amino]-1,3-thiazol-4-yl]benzoate Openeye Name: methyl 3-[2-[(N'-methylcarbamimidoyl)amino]thiazol-4-yl]benzoate CAS Name: 3-[2-[[amino(methylimino)methyl]amino]-4-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[(N'-methylcarbamimidoyl)amino]-1,3-thiazol-4-yl]benzoate Traditional Name: 3-[2-[(N'-methylamidino)amino]thiazol-4-yl]benzoic acid methyl ester Formula: C13H14N4O2S MolecularWeight: 290.34086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)NC1=NC(=CS1)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CN=C(N)NC1=NC(=CS1)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C13H14N4O2S/c1-15-12(14)17-13-16-10(7-20-13)8-4-3-5-9(6-8)11(18)19-2/h3-7H,1-2H3,(H3,14,15,16,17)