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

Systemtic Name: 4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole Openeye Name: 4-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)thiazole CAS Name: 4-[[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]-2-(3,4-dimethoxyphenyl)thiazole IUPAC Name: 4-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole Traditional Name: 4-[[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-2-(3,4-dimethoxyphenyl)thiazole Formula: C23H28N4O2S2 MolecularWeight: 456.62402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4CCCCC4)OC

InChI

InChI=1S/C23H28N4O2S2/c1-4-12-27-21(16-8-6-5-7-9-16)25-26-23(27)31-15-18-14-30-22(24-18)17-10-11-19(28-2)20(13-17)29-3/h4,10-11,13-14,16H,1,5-9,12,15H2,2-3H3