7-phenyl-N-[4-(1,3-thiazol-3-ium-2-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride

Systemtic Name: 7-phenyl-N-[4-(1,3-thiazol-3-ium-2-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride Openeye Name: 7-phenyl-N-[4-(thiazol-3-ium-2-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride CAS Name: 7-phenyl-N-[4-(2-thiazol-3-iumylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride IUPAC Name: 7-phenyl-N-[4-(1,3-thiazol-3-ium-2-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride Traditional Name: 7-phenyl-N-[4-(thiazol-3-ium-2-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride Formula: C27H23ClN2OS MolecularWeight: 459.00232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=C1C=CC(=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)CC5=[NH+]C=CS5.[Cl-]

Isomeric SMILES

C1CC(=CC2=C1C=CC(=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)CC5=[NH+]C=CS5.[Cl-]

InChI

InChI=1S/C27H22N2OS.ClH/c30-27(29-25-12-6-19(7-13-25)16-26-28-14-15-31-26)23-11-9-21-8-10-22(17-24(21)18-23)20-4-2-1-3-5-20;/h1-8,10,12-15,17-18H,9,11,16H2,(H,29,30);1H