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

Systemtic Name: 2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-2-phenyl-ethanamide Openeye Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-2-phenyl-acetamide CAS Name: 2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxyphenyl)-2-phenylacetamide IUPAC Name: 2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-2-phenylacetamide Traditional Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxyphenyl)-2-phenyl-acetamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3CC=C)C4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3CC=C)C4CCCCC4

InChI

InChI=1S/C26H30N4O2S/c1-3-18-30-24(20-12-8-5-9-13-20)28-29-26(30)33-23(19-10-6-4-7-11-19)25(31)27-21-14-16-22(32-2)17-15-21/h3-4,6-7,10-11,14-17,20,23H,1,5,8-9,12-13,18H2,2H3,(H,27,31)