4-[5-(diethylaminomethyl)-3-methylsulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyridin-2-amine

Systemtic Name: 4-[5-(diethylaminomethyl)-3-methylsulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyridin-2-amine Openeye Name: 4-[5-(diethylaminomethyl)-3-methylsulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyridin-2-amine CAS Name: 4-[5-(diethylaminomethyl)-3-(methylthio)-1-phenyl-4-pyrazolyl]-N-phenyl-2-pyridinamine IUPAC Name: 4-[5-(diethylaminomethyl)-3-methylsulfanyl-1-phenylpyrazol-4-yl]-N-phenylpyridin-2-amine Traditional Name: [4-(2-anilino-4-pyridyl)-5-(methylthio)-2-phenyl-pyrazol-3-yl]methyl-diethyl-amine Formula: C26H29N5S MolecularWeight: 443.60696

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=CC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CCN(CC)CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=CC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C26H29N5S/c1-4-30(5-2)19-23-25(26(32-3)29-31(23)22-14-10-7-11-15-22)20-16-17-27-24(18-20)28-21-12-8-6-9-13-21/h6-18H,4-5,19H2,1-3H3,(H,27,28)