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

Systemtic Name: N-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]ethyl]-4-methyl-benzenesulfonamide Formula: C20H28N4O2S2 MolecularWeight: 420.59192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCSC2=NN=C(N2CC=C)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCSC2=NN=C(N2CC=C)C3CCCCC3

InChI

InChI=1S/C20H28N4O2S2/c1-3-14-24-19(17-7-5-4-6-8-17)22-23-20(24)27-15-13-21-28(25,26)18-11-9-16(2)10-12-18/h3,9-12,17,21H,1,4-8,13-15H2,2H3