2-[[2-(3-imidazol-1-ylpropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid

Systemtic Name: 2-[[2-(3-imidazol-1-ylpropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid Openeye Name: 6-[[2-(3-imidazol-1-ylpropylamino)phenyl]sulfonylamino]tetralin-5-carboxylic acid CAS Name: 2-[[2-[3-(1-imidazolyl)propylamino]phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid IUPAC Name: 2-[[2-(3-imidazol-1-ylpropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid Traditional Name: 6-[[2-(3-imidazol-1-ylpropylamino)phenyl]sulfonylamino]tetralin-5-carboxylic acid Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2C(=O)O)NS(=O)(=O)C3=CC=CC=C3NCCCN4C=CN=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2C(=O)O)NS(=O)(=O)C3=CC=CC=C3NCCCN4C=CN=C4

InChI

InChI=1S/C23H26N4O4S/c28-23(29)22-18-7-2-1-6-17(18)10-11-20(22)26-32(30,31)21-9-4-3-8-19(21)25-12-5-14-27-15-13-24-16-27/h3-4,8-11,13,15-16,25-26H,1-2,5-7,12,14H2,(H,28,29)