N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-(5-methyl-1-pyrazolyl)benzamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-(5-methylpyrazol-1-yl)benzamide Formula: C22H28N6OS MolecularWeight: 424.56232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)NCCCC3=NN=C(N3C4CCCC4)SC

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)NCCCC3=NN=C(N3C4CCCC4)SC

InChI

InChI=1S/C22H28N6OS/c1-16-13-15-24-28(16)19-11-9-17(10-12-19)21(29)23-14-5-8-20-25-26-22(30-2)27(20)18-6-3-4-7-18/h9-13,15,18H,3-8,14H2,1-2H3,(H,23,29)