4-oxidanylidene-4-[[2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-yl]amino]butanoic acid Openeye Name: 4-oxo-4-[(2-thiazol-4-yl-3H-benzimidazol-5-yl)amino]butanoic acid CAS Name: 4-oxo-4-[[2-(4-thiazolyl)-3H-benzimidazol-5-yl]amino]butanoic acid IUPAC Name: 4-oxo-4-[[2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-yl]amino]butanoic acid Traditional Name: 4-keto-4-[(2-thiazol-4-yl-3H-benzimidazol-5-yl)amino]butyric acid Formula: C14H12N4O3S MolecularWeight: 316.33508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CCC(=O)O)NC(=N2)C3=CSC=N3

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CCC(=O)O)NC(=N2)C3=CSC=N3

InChI

InChI=1S/C14H12N4O3S/c19-12(3-4-13(20)21)16-8-1-2-9-10(5-8)18-14(17-9)11-6-22-7-15-11/h1-2,5-7H,3-4H2,(H,16,19)(H,17,18)(H,20,21)