2-(2-chlorophenyl)-4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(2-chlorophenyl)-4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2-chlorophenyl)thiazole CAS Name: 2-(2-chlorophenyl)-4-[[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(2-chlorophenyl)-4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-2-(2-chlorophenyl)thiazole Formula: C21H23ClN4S2 MolecularWeight: 431.01712

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3Cl)C4CCCCC4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3Cl)C4CCCCC4

InChI

InChI=1S/C21H23ClN4S2/c1-2-12-26-19(15-8-4-3-5-9-15)24-25-21(26)28-14-16-13-27-20(23-16)17-10-6-7-11-18(17)22/h2,6-7,10-11,13,15H,1,3-5,8-9,12,14H2