N-[(5-bromanyl-1-benzothiophen-3-yl)methyl]-2-chloranyl-N-(phenylmethyl)ethanamine hydrochloride

Systemtic Name: N-[(5-bromanyl-1-benzothiophen-3-yl)methyl]-2-chloranyl-N-(phenylmethyl)ethanamine hydrochloride Openeye Name: N-benzyl-N-[(5-bromobenzothiophen-3-yl)methyl]-2-chloro-ethanamine hydrochloride CAS Name: N-[(5-bromo-1-benzothiophen-3-yl)methyl]-2-chloro-N-(phenylmethyl)ethanamine hydrochloride IUPAC Name: N-benzyl-N-[(5-bromo-1-benzothiophen-3-yl)methyl]-2-chloroethanamine hydrochloride Traditional Name: benzyl-[(5-bromobenzothiophen-3-yl)methyl]-(2-chloroethyl)amine hydrochloride Formula: C18H18BrCl2NS MolecularWeight: 431.21722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCl)CC2=CSC3=C2C=C(C=C3)Br.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCl)CC2=CSC3=C2C=C(C=C3)Br.Cl

InChI

InChI=1S/C18H17BrClNS.ClH/c19-16-6-7-18-17(10-16)15(13-22-18)12-21(9-8-20)11-14-4-2-1-3-5-14;/h1-7,10,13H,8-9,11-12H2;1H