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

Systemtic Name: [5-(4-propylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone Openeye Name: [5-(4-propylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-(3-pyridyl)methanone CAS Name: [5-[4-(propylthio)phenyl]-3,4-dihydropyrazol-2-yl]-(3-pyridinyl)methanone IUPAC Name: [5-(4-propylsulfanylphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone Traditional Name: [3-[4-(propylthio)phenyl]-2-pyrazolin-1-yl]-(3-pyridyl)methanone Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=C(C=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCCSC1=CC=C(C=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-2-12-23-16-7-5-14(6-8-16)17-9-11-21(20-17)18(22)15-4-3-10-19-13-15/h3-8,10,13H,2,9,11-12H2,1H3