2-[(4-chlorophenyl)sulfanylmethyl]-N-[5-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-3-yl]quinolin-4-amine

Systemtic Name: 2-[(4-chlorophenyl)sulfanylmethyl]-N-[5-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-3-yl]quinolin-4-amine Openeye Name: 2-[(4-chlorophenyl)sulfanylmethyl]-N-[5-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-3-yl]quinolin-4-amine CAS Name: 2-[[(4-chlorophenyl)thio]methyl]-N-[5-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-3-yl]-4-quinolinamine IUPAC Name: 2-[(4-chlorophenyl)sulfanylmethyl]-N-[5-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-3-yl]quinolin-4-amine Traditional Name: [2-[[(4-chlorophenyl)thio]methyl]-4-quinolyl]-[5-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazol-3-yl]amine Formula: C23H19ClN6S MolecularWeight: 446.95516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C2=CC(=NN2)NC3=CC(=NC4=CC=CC=C43)CSC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC(=NN1)C2=CC(=NN2)NC3=CC(=NC4=CC=CC=C43)CSC5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H19ClN6S/c1-14-10-21(28-27-14)22-12-23(30-29-22)26-20-11-16(25-19-5-3-2-4-18(19)20)13-31-17-8-6-15(24)7-9-17/h2-12H,13H2,1H3,(H,27,28)(H2,25,26,29,30)