4-(3,5-dimethylpyrazol-1-yl)-N-(3-phenylsulfanylpropyl)benzamide

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-phenylsulfanylpropyl)benzamide Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-phenylsulfanylpropyl)benzamide CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-N-[3-(phenylthio)propyl]benzamide IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-phenylsulfanylpropyl)benzamide Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-N-[3-(phenylthio)propyl]benzamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)NCCCSC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)NCCCSC3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3OS/c1-16-15-17(2)24(23-16)19-11-9-18(10-12-19)21(25)22-13-6-14-26-20-7-4-3-5-8-20/h3-5,7-12,15H,6,13-14H2,1-2H3,(H,22,25)