N-cyclopropyl-2-[2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[[5-(4-methoxyphenyl)-1H-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=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

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