3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(3-propan-2-ylphenyl)benzamide

Systemtic Name: 3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(3-propan-2-ylphenyl)benzamide Openeye Name: N-(3-isopropylphenyl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-(3-propan-2-ylphenyl)benzamide IUPAC Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(3-propan-2-ylphenyl)benzamide Traditional Name: N-m-cumenyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O2S/c1-14(2)15-6-4-9-18(10-15)24-20(28)16-7-5-8-17(11-16)23-19(27)12-29-21-25-22-13-26(21)3/h4-11,13-14H,12H2,1-3H3,(H,23,27)(H,24,28)