methyl 3-[2-[bis(azanyl)methylideneamino]-4-methyl-1,3-thiazol-5-yl]benzoate

Systemtic Name: methyl 3-[2-[bis(azanyl)methylideneamino]-4-methyl-1,3-thiazol-5-yl]benzoate Openeye Name: methyl 3-(2-guanidino-4-methyl-thiazol-5-yl)benzoate CAS Name: 3-[2-(diaminomethylideneamino)-4-methyl-5-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(diaminomethylideneamino)-4-methyl-1,3-thiazol-5-yl]benzoate Traditional Name: 3-(2-guanidino-4-methyl-thiazol-5-yl)benzoic acid methyl ester Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(N)N)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)N=C(N)N)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C13H14N4O2S/c1-7-10(20-13(16-7)17-12(14)15)8-4-3-5-9(6-8)11(18)19-2/h3-6H,1-2H3,(H4,14,15,16,17)