N-[3-methyl-4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[3-methyl-4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]cyclohexanecarboxamide Openeye Name: N-[3-methyl-4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]cyclohexanecarboxamide CAS Name: N-[3-methyl-4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]cyclohexanecarboxamide IUPAC Name: N-[3-methyl-4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]cyclohexanecarboxamide Traditional Name: N-[3-methyl-4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]cyclohexanecarboxamide Formula: C23H27N5O2S2 MolecularWeight: 469.62278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCCCC2)NC(=O)CSC3=NN=C(N3C)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCCCC2)NC(=O)CSC3=NN=C(N3C)C4=CC=CS4

InChI

InChI=1S/C23H27N5O2S2/c1-15-13-17(24-22(30)16-7-4-3-5-8-16)10-11-18(15)25-20(29)14-32-23-27-26-21(28(23)2)19-9-6-12-31-19/h6,9-13,16H,3-5,7-8,14H2,1-2H3,(H,24,30)(H,25,29)