2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[(4-allyl-5-cyclopentyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide CAS Name: 2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-N-(2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide Traditional Name: 2-[(4-allyl-5-cyclopentyl-1,2,4-triazol-3-yl)thio]-N-(2,5-dimethoxyphenyl)acetamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC=C)C3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC=C)C3CCCC3

InChI

InChI=1S/C20H26N4O3S/c1-4-11-24-19(14-7-5-6-8-14)22-23-20(24)28-13-18(25)21-16-12-15(26-2)9-10-17(16)27-3/h4,9-10,12,14H,1,5-8,11,13H2,2-3H3,(H,21,25)