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

Systemtic Name: 7-phenyl-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride Openeye Name: 7-phenyl-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride CAS Name: 7-phenyl-N-[4-(3-thiazol-3-iumylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride IUPAC Name: 7-phenyl-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]-3,4-dihydronaphthalene-2-carboxamide chloride Traditional Name: 7-phenyl-N-[4-(thiazol-3-ium-3-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)C[N+]5=CSC=C5.[Cl-]

Isomeric SMILES

C1CC(=CC2=C1C=CC(=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C[N+]5=CSC=C5.[Cl-]

InChI

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