N-(2-ethylphenyl)-2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methyl-amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]-methyl-amino]acetamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)CSC2=NN=C(N2CC)C3=CC=CS3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)CSC2=NN=C(N2CC)C3=CC=CS3

InChI

InChI=1S/C21H25N5O2S2/c1-4-15-9-6-7-10-16(15)22-18(27)13-25(3)19(28)14-30-21-24-23-20(26(21)5-2)17-11-8-12-29-17/h6-12H,4-5,13-14H2,1-3H3,(H,22,27)