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

Systemtic Name: N-cyclopropyl-2-[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

COC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

InChI=1S/C21H21N5O3S/c1-29-18-9-5-4-8-17(18)26-13-22-25-21(26)30-12-19(27)24-16-7-3-2-6-15(16)20(28)23-14-10-11-14/h2-9,13-14H,10-12H2,1H3,(H,23,28)(H,24,27)