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

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2-(3,5-dimethylphenoxy)ethanamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2-(3,5-dimethylphenoxy)acetamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-2-(3,5-dimethylphenoxy)acetamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2-(3,5-dimethylphenoxy)acetamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-2-(3,5-dimethylphenoxy)acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NCCCC2=NN=C(N2C3CCCC3)SC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NCCCC2=NN=C(N2C3CCCC3)SC)C

InChI

InChI=1S/C21H30N4O2S/c1-15-11-16(2)13-18(12-15)27-14-20(26)22-10-6-9-19-23-24-21(28-3)25(19)17-7-4-5-8-17/h11-13,17H,4-10,14H2,1-3H3,(H,22,26)