(1S)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-yl-ethanamine

Systemtic Name: (1S)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-yl-ethanamine Openeye Name: (1S)-N-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]-1-(2-thienyl)ethanamine CAS Name: (1S)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-ylethanamine IUPAC Name: (1S)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-ylethanamine Traditional Name: [5-(p-tolyl)-1H-pyrazol-4-yl]methyl-[(1S)-1-(2-thienyl)ethyl]amine Formula: C17H19N3S MolecularWeight: 297.41786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)CNC(C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)CN[C@@H](C)C3=CC=CS3

InChI

InChI=1S/C17H19N3S/c1-12-5-7-14(8-6-12)17-15(11-19-20-17)10-18-13(2)16-4-3-9-21-16/h3-9,11,13,18H,10H2,1-2H3,(H,19,20)/t13-/m0/s1