2-[[4-(3-acetamidophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-1-thiophen-2-yl-propyl)ethanamide

Systemtic Name: 2-[[4-(3-acetamidophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-1-thiophen-2-yl-propyl)ethanamide Openeye Name: 2-[[4-(3-acetamidophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-methyl-1-(2-thienyl)propyl]acetamide CAS Name: 2-[[4-(3-acetamidophenyl)-5-methyl-1,2,4-triazol-3-yl]thio]-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide IUPAC Name: 2-[[4-(3-acetamidophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide Traditional Name: 2-[[4-(3-acetamidophenyl)-5-methyl-1,2,4-triazol-3-yl]thio]-N-[2-methyl-1-(2-thienyl)propyl]acetamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)SCC(=O)NC(C3=CC=CS3)C(C)C

Isomeric SMILES

CC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)SCC(=O)NC(C3=CC=CS3)C(C)C

InChI

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