N-(5-tert-butyl-2-methoxy-phenyl)-3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)NC(=O)CSC3=NN=CN3C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)NC(=O)CSC3=NN=CN3C

InChI

InChI=1S/C23H27N5O3S/c1-23(2,3)16-9-10-19(31-5)18(12-16)26-21(30)15-7-6-8-17(11-15)25-20(29)13-32-22-27-24-14-28(22)4/h6-12,14H,13H2,1-5H3,(H,25,29)(H,26,30)