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

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]ethanamine Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ethanamine CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]ethanamine IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]ethanamine Traditional Name: 2-[(1-methylimidazol-2-yl)thio]ethyl-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]amine Formula: C17H21N5S MolecularWeight: 327.44714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)CNCCSC3=NC=CN3C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)CNCCSC3=NC=CN3C

InChI

InChI=1S/C17H21N5S/c1-13-3-5-14(6-4-13)16-15(12-20-21-16)11-18-8-10-23-17-19-7-9-22(17)2/h3-7,9,12,18H,8,10-11H2,1-2H3,(H,20,21)