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

Systemtic Name: N-(4-butoxyphenyl)-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-butoxyphenyl)-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-butoxyphenyl)-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-butoxyphenyl)-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-butoxyphenyl)-2-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c1-2-3-18-32-23-16-14-21(15-17-23)27-24(31)19-33-26-29-28-25(20-10-6-4-7-11-20)30(26)22-12-8-5-9-13-22/h4,6-7,10-11,14-17,22H,2-3,5,8-9,12-13,18-19H2,1H3,(H,27,31)