(3-methylthiophen-2-yl)methyl-[(2S)-2-oxidanylpropyl]-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]azanium

Systemtic Name: (3-methylthiophen-2-yl)methyl-[(2S)-2-oxidanylpropyl]-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]azanium Openeye Name: [(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]-[[5-(2-thienyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: [(2S)-2-hydroxypropyl]-[(3-methyl-2-thiophenyl)methyl]-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]ammonium IUPAC Name: [(2S)-2-hydroxypropyl]-[(3-methylthiophen-2-yl)methyl]-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]azanium Traditional Name: [(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]-[[5-(2-thienyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C17H22N3OS2+ MolecularWeight: 348.50608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](CC2=C(NN=C2)C3=CC=CS3)CC(C)O

Isomeric SMILES

CC1=C(SC=C1)C[NH+](CC2=C(NN=C2)C3=CC=CS3)C[C@H](C)O

InChI

InChI=1S/C17H21N3OS2/c1-12-5-7-23-16(12)11-20(9-13(2)21)10-14-8-18-19-17(14)15-4-3-6-22-15/h3-8,13,21H,9-11H2,1-2H3,(H,18,19)/p+1/t13-/m0/s1