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

Systemtic Name: N-cyclopropyl-3-[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-3-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-3-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-3-[[2-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-3-[[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(=C3)C(=O)NC4CC4

Isomeric SMILES

COC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC(=C3)C(=O)NC4CC4

InChI

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