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

Systemtic Name: 4-[[4-(2-azanyl-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 4-[[4-(2-amino-4-methyl-thiazol-5-yl)thiazol-2-yl]amino]benzoate CAS Name: 4-[[4-(2-amino-4-methyl-5-thiazolyl)-2-thiazolyl]amino]benzoate IUPAC Name: 4-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 4-[[4-(2-amino-4-methyl-thiazol-5-yl)thiazol-2-yl]amino]benzoate Formula: C14H11N4O2S2- MolecularWeight: 331.39274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)N)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C14H12N4O2S2/c1-7-11(22-13(15)16-7)10-6-21-14(18-10)17-9-4-2-8(3-5-9)12(19)20/h2-6H,1H3,(H2,15,16)(H,17,18)(H,19,20)/p-1