1-(4-cyclopropylcarbonylpiperazin-1-yl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-cyclopropylcarbonylpiperazin-1-yl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-[4-(cyclopropanecarbonyl)piperazino]-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]ethanone Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=C(C=C2)OC)SCC(=O)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=NN=C(N1C2=CC=C(C=C2)OC)SCC(=O)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C20H25N5O3S/c1-14-21-22-20(25(14)16-5-7-17(28-2)8-6-16)29-13-18(26)23-9-11-24(12-10-23)19(27)15-3-4-15/h5-8,15H,3-4,9-13H2,1-2H3