3-(1-benzothiophen-3-yl)-2-[[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(1-benzothiophen-3-yl)-2-[[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]carbonylamino]propanoic acid Openeye Name: 3-(benzothiophen-3-yl)-2-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbonyl]amino]propanoic acid CAS Name: 3-(1-benzothiophen-3-yl)-2-[[oxo-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]methyl]amino]propanoic acid IUPAC Name: 3-(1-benzothiophen-3-yl)-2-[[4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbonyl]amino]propanoic acid Traditional Name: 3-(benzothiophen-3-yl)-2-[[4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbonyl]amino]propionic acid Formula: C24H24N4O4S MolecularWeight: 464.53676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)NC(CC4=CSC5=CC=CC=C54)C(=O)O

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)NC(CC4=CSC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C24H24N4O4S/c29-22(30)19(13-15-14-33-21-8-4-1-5-17(15)21)26-23(31)27-11-9-16(10-12-27)28-20-7-3-2-6-18(20)25-24(28)32/h1-8,14,16,19H,9-13H2,(H,25,32)(H,26,31)(H,29,30)