2-chloranyl-N,N-diethyl-4-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: 2-chloranyl-N,N-diethyl-4-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 2-chloro-N,N-diethyl-4-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 2-chloro-N,N-diethyl-4-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-chloro-N,N-diethyl-4-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 2-chloro-N,N-diethyl-4-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C21H24ClN5O2S2 MolecularWeight: 478.03056

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)C(=O)N(CC)CC)Cl)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)C(=O)N(CC)CC)Cl)C3=CC=CS3

InChI

InChI=1S/C21H24ClN5O2S2/c1-4-26(5-2)20(29)15-10-9-14(12-16(15)22)23-18(28)13-31-21-25-24-19(27(21)6-3)17-8-7-11-30-17/h7-12H,4-6,13H2,1-3H3,(H,23,28)