1-(5-methyl-1-phenyl-pyrazol-4-yl)-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]ethanamine

Systemtic Name: 1-(5-methyl-1-phenyl-pyrazol-4-yl)-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]ethanamine Openeye Name: 1-(5-methyl-1-phenyl-pyrazol-4-yl)-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]ethanamine CAS Name: 1-(5-methyl-1-phenyl-4-pyrazolyl)-N-[[2-(methylthio)-5-pyrimidinyl]methyl]ethanamine IUPAC Name: 1-(5-methyl-1-phenylpyrazol-4-yl)-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]ethanamine Traditional Name: 1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl-[[2-(methylthio)pyrimidin-5-yl]methyl]amine Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)NCC3=CN=C(N=C3)SC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(C)NCC3=CN=C(N=C3)SC

InChI

InChI=1S/C18H21N5S/c1-13(19-9-15-10-20-18(24-3)21-11-15)17-12-22-23(14(17)2)16-7-5-4-6-8-16/h4-8,10-13,19H,9H2,1-3H3