[5-(3-ethylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone

Systemtic Name: [5-(3-ethylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone Openeye Name: [5-(3-ethylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-(3-pyridyl)methanone CAS Name: [5-[3-(ethylthio)phenyl]-3,4-dihydropyrazol-2-yl]-(3-pyridinyl)methanone IUPAC Name: [5-(3-ethylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone Traditional Name: [3-[3-(ethylthio)phenyl]-2-pyrazolin-1-yl]-(3-pyridyl)methanone Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCSC1=CC=CC(=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H17N3OS/c1-2-22-15-7-3-5-13(11-15)16-8-10-20(19-16)17(21)14-6-4-9-18-12-14/h3-7,9,11-12H,2,8,10H2,1H3