2-[(2S)-4-[(5-methylthiophen-2-yl)methyl]-1-(phenylmethyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(5-methylthiophen-2-yl)methyl]-1-(phenylmethyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-benzyl-4-[(5-methyl-2-thienyl)methyl]piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(5-methyl-2-thiophenyl)methyl]-1-(phenylmethyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-benzyl-4-[(5-methylthiophen-2-yl)methyl]piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-benzyl-4-[(5-methyl-2-thienyl)methyl]piperazin-4-ium-2-yl]ethanol Formula: C19H27N2OS+ MolecularWeight: 331.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+]2CCN(C(C2)CCO)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C[NH+]2CCN([C@H](C2)CCO)CC3=CC=CC=C3

InChI

InChI=1S/C19H26N2OS/c1-16-7-8-19(23-16)15-20-10-11-21(18(14-20)9-12-22)13-17-5-3-2-4-6-17/h2-8,18,22H,9-15H2,1H3/p+1/t18-/m0/s1