N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-(methylsulfanylmethyl)benzamide

Systemtic Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-(methylsulfanylmethyl)benzamide Openeye Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-(methylsulfanylmethyl)benzamide CAS Name: N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-4-[(methylthio)methyl]benzamide IUPAC Name: N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-4-(methylsulfanylmethyl)benzamide Traditional Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-[(methylthio)methyl]benzamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)C2=CC=C(C=C2)CSC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)C2=CC=C(C=C2)CSC)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3OS/c1-17-20(15-25(24-17)21-8-4-3-5-9-21)7-6-14-23-22(26)19-12-10-18(11-13-19)16-27-2/h3-5,8-13,15H,6-7,14,16H2,1-2H3,(H,23,26)