N-ethyl-2-[2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-ethyl-2-[2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: N-ethyl-2-[[2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: N-ethyl-2-[[2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-ethyl-2-[[2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: N-ethyl-2-[[2-[[4-(2-ethylphenyl)-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:

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NCC

Isomeric SMILES

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NCC

InChI

InChI=1S/C21H23N5O2S/c1-3-15-9-5-8-12-18(15)26-14-23-25-21(26)29-13-19(27)24-17-11-7-6-10-16(17)20(28)22-4-2/h5-12,14H,3-4,13H2,1-2H3,(H,22,28)(H,24,27)