2-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-(m-tolyl)benzamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NNC(=N3)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NNC(=N3)C(C)(C)C

InChI

InChI=1S/C22H25N5O2S/c1-14-8-7-9-15(12-14)23-19(29)16-10-5-6-11-17(16)24-18(28)13-30-21-25-20(26-27-21)22(2,3)4/h5-12H,13H2,1-4H3,(H,23,29)(H,24,28)(H,25,26,27)