2-[2-[[4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[[4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[[4-isopropyl-5-(5-isopropyl-3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[1-oxo-2-[[4-propan-2-yl-5-(5-propan-2-yl-3-thiophenyl)-1,2,4-triazol-3-yl]thio]ethyl]amino]benzamide IUPAC Name: 2-[[2-[[4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[[4-isopropyl-5-(5-isopropyl-3-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CS1)C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=CC=C3C(=O)N

Isomeric SMILES

CC(C)C1=CC(=CS1)C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C21H25N5O2S2/c1-12(2)17-9-14(10-29-17)20-24-25-21(26(20)13(3)4)30-11-18(27)23-16-8-6-5-7-15(16)19(22)28/h5-10,12-13H,11H2,1-4H3,(H2,22,28)(H,23,27)