4-(2-chloranyl-4-methoxy-5-methyl-phenyl)-5-methyl-N-(4-phenyloct-1-yn-3-yl)-1,3-thiazol-2-amine hydrochloride

Systemtic Name: 4-(2-chloranyl-4-methoxy-5-methyl-phenyl)-5-methyl-N-(4-phenyloct-1-yn-3-yl)-1,3-thiazol-2-amine hydrochloride Openeye Name: 4-(2-chloro-4-methoxy-5-methyl-phenyl)-N-(1-ethynyl-2-phenyl-hexyl)-5-methyl-thiazol-2-amine hydrochloride CAS Name: 4-(2-chloro-4-methoxy-5-methylphenyl)-5-methyl-N-(4-phenyloct-1-yn-3-yl)-2-thiazolamine hydrochloride IUPAC Name: 4-(2-chloro-4-methoxy-5-methylphenyl)-5-methyl-N-(4-phenyloct-1-yn-3-yl)-1,3-thiazol-2-amine hydrochloride Traditional Name: [4-(2-chloro-4-methoxy-5-methyl-phenyl)-5-methyl-thiazol-2-yl]-[1-(1-phenylpentyl)prop-2-ynyl]amine hydrochloride Formula: C26H30Cl2N2OS MolecularWeight: 489.5002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)C(C#C)NC2=NC(=C(S2)C)C3=CC(=C(C=C3Cl)OC)C.Cl

Isomeric SMILES

CCCCC(C1=CC=CC=C1)C(C#C)NC2=NC(=C(S2)C)C3=CC(=C(C=C3Cl)OC)C.Cl

InChI

InChI=1S/C26H29ClN2OS.ClH/c1-6-8-14-20(19-12-10-9-11-13-19)23(7-2)28-26-29-25(18(4)31-26)21-15-17(3)24(30-5)16-22(21)27;/h2,9-13,15-16,20,23H,6,8,14H2,1,3-5H3,(H,28,29);1H