N-methyl-3-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)NC)C3=CC(=CC=C3)C

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)NC)C3=CC(=CC=C3)C

InChI

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