2-[4-[4-(4-chlorophenyl)phenyl]sulfanyl-3,5-diethyl-pyrazol-1-yl]ethanamine

Systemtic Name: 2-[4-[4-(4-chlorophenyl)phenyl]sulfanyl-3,5-diethyl-pyrazol-1-yl]ethanamine Openeye Name: 2-[4-[4-(4-chlorophenyl)phenyl]sulfanyl-3,5-diethyl-pyrazol-1-yl]ethanamine CAS Name: 2-[4-[[4-(4-chlorophenyl)phenyl]thio]-3,5-diethyl-1-pyrazolyl]ethanamine IUPAC Name: 2-[4-[4-(4-chlorophenyl)phenyl]sulfanyl-3,5-diethylpyrazol-1-yl]ethanamine Traditional Name: 2-[4-[[4-(4-chlorophenyl)phenyl]thio]-3,5-diethyl-pyrazol-1-yl]ethylamine Formula: C21H24ClN3S MolecularWeight: 385.95336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CCN)CC)SC2=CC=C(C=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C(=NN1CCN)CC)SC2=CC=C(C=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3S/c1-3-19-21(20(4-2)25(24-19)14-13-23)26-18-11-7-16(8-12-18)15-5-9-17(22)10-6-15/h5-12H,3-4,13-14,23H2,1-2H3