4-tert-butyl-N-[2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide Openeye Name: N-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]benzamide IUPAC Name: N-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-tert-butylbenzamide Traditional Name: N-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]acetyl]-4-tert-butyl-benzamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C)CC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O2S/c1-23(2,3)18-12-10-17(11-13-18)21(29)24-20(28)15-30-22-26-25-19(27(22)4)14-16-8-6-5-7-9-16/h5-13H,14-15H2,1-4H3,(H,24,28,29)