N-(2-methylpropyl)-N-[5-(trifluoromethyl)-1-benzothiophen-3-yl]pyridin-4-amine hydrochloride

Systemtic Name: N-(2-methylpropyl)-N-[5-(trifluoromethyl)-1-benzothiophen-3-yl]pyridin-4-amine hydrochloride Openeye Name: N-isobutyl-N-[5-(trifluoromethyl)benzothiophen-3-yl]pyridin-4-amine hydrochloride CAS Name: N-(2-methylpropyl)-N-[5-(trifluoromethyl)-1-benzothiophen-3-yl]-4-pyridinamine hydrochloride IUPAC Name: N-(2-methylpropyl)-N-[5-(trifluoromethyl)-1-benzothiophen-3-yl]pyridin-4-amine hydrochloride Traditional Name: isobutyl-(4-pyridyl)-[5-(trifluoromethyl)benzothiophen-3-yl]amine hydrochloride Formula: C18H18ClF3N2S MolecularWeight: 386.86213

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=CC=NC=C1)C2=CSC3=C2C=C(C=C3)C(F)(F)F.Cl

Isomeric SMILES

CC(C)CN(C1=CC=NC=C1)C2=CSC3=C2C=C(C=C3)C(F)(F)F.Cl

InChI

InChI=1S/C18H17F3N2S.ClH/c1-12(2)10-23(14-5-7-22-8-6-14)16-11-24-17-4-3-13(9-15(16)17)18(19,20)21;/h3-9,11-12H,10H2,1-2H3;1H