3-[5-[(4-azanyl-3-chloranyl-phenyl)sulfonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid

Systemtic Name: 3-[5-[(4-azanyl-3-chloranyl-phenyl)sulfonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid Openeye Name: 3-[5-[(4-amino-3-chloro-phenyl)sulfonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid CAS Name: 3-[5-[(4-amino-3-chlorophenyl)sulfonylamino]-1-benzimidazolyl]-3-phenylpropanoic acid IUPAC Name: 3-[5-[(4-amino-3-chlorophenyl)sulfonylamino]benzimidazol-1-yl]-3-phenylpropanoic acid Traditional Name: 3-[5-[(4-amino-3-chloro-phenyl)sulfonylamino]benzimidazol-1-yl]-3-phenyl-propionic acid Formula: C22H19ClN4O4S MolecularWeight: 470.92866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NS(=O)(=O)C4=CC(=C(C=C4)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NS(=O)(=O)C4=CC(=C(C=C4)N)Cl

InChI

InChI=1S/C22H19ClN4O4S/c23-17-11-16(7-8-18(17)24)32(30,31)26-15-6-9-20-19(10-15)25-13-27(20)21(12-22(28)29)14-4-2-1-3-5-14/h1-11,13,21,26H,12,24H2,(H,28,29)