N-[(2-chlorophenyl)methyl]-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-chlorophenyl)methyl]acetamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(2-chlorobenzyl)acetamide Formula: C20H25ClN4OS MolecularWeight: 404.9567

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2Cl)C3CCCCC3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2Cl)C3CCCCC3

InChI

InChI=1S/C20H25ClN4OS/c1-2-12-25-19(15-8-4-3-5-9-15)23-24-20(25)27-14-18(26)22-13-16-10-6-7-11-17(16)21/h2,6-7,10-11,15H,1,3-5,8-9,12-14H2,(H,22,26)