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

Systemtic Name: ethyl 3-[[2-[bis(azanyl)methylideneamino]-4-methyl-1,3-thiazol-5-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[(2-guanidino-4-methyl-thiazole-5-carbonyl)amino]benzoate CAS Name: 3-[[[2-(diaminomethylideneamino)-4-methyl-5-thiazolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(diaminomethylideneamino)-4-methyl-1,3-thiazole-5-carbonyl]amino]benzoate Traditional Name: 3-[(2-guanidino-4-methyl-thiazole-5-carbonyl)amino]benzoic acid ethyl ester Formula: C15H17N5O3S MolecularWeight: 347.39218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=C(S2)N=C(N)N)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=C(S2)N=C(N)N)C

InChI

InChI=1S/C15H17N5O3S/c1-3-23-13(22)9-5-4-6-10(7-9)19-12(21)11-8(2)18-15(24-11)20-14(16)17/h4-7H,3H2,1-2H3,(H,19,21)(H4,16,17,18,20)