2-cyclopentyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]ethanamide

Systemtic Name: 2-cyclopentyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]ethanamide Openeye Name: N-[[4-allyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2-cyclopentyl-acetamide CAS Name: 2-cyclopentyl-N-[[5-[(3-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]acetamide IUPAC Name: 2-cyclopentyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]acetamide Traditional Name: N-[[4-allyl-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-2-cyclopentyl-acetamide Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)CNC(=O)CC3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)CNC(=O)CC3CCCC3

InChI

InChI=1S/C21H28N4OS/c1-3-11-25-19(14-22-20(26)13-17-8-4-5-9-17)23-24-21(25)27-15-18-10-6-7-16(2)12-18/h3,6-7,10,12,17H,1,4-5,8-9,11,13-15H2,2H3,(H,22,26)