3-[3-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(3,3-dimethyl-2-oxo-butyl)sulfanyl-5-(2-thienyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[(3,3-dimethyl-2-oxobutyl)thio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-(3,3-dimethyl-2-oxobutyl)sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[(2-keto-3,3-dimethyl-butyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]propionamide Formula: C15H20N4O2S2 MolecularWeight: 352.4749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C(N1CCC(=O)N)C2=CC=CS2

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C(N1CCC(=O)N)C2=CC=CS2

InChI

InChI=1S/C15H20N4O2S2/c1-15(2,3)11(20)9-23-14-18-17-13(10-5-4-8-22-10)19(14)7-6-12(16)21/h4-5,8H,6-7,9H2,1-3H3,(H2,16,21)