3-[3-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[2-(tert-butylamino)-2-oxo-ethyl]sulfanyl-5-(2-thienyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[[2-(tert-butylamino)-2-oxoethyl]thio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[[2-(tert-butylamino)-2-keto-ethyl]thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]propionamide Formula: C15H21N5O2S2 MolecularWeight: 367.48954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N5O2S2/c1-15(2,3)17-12(22)9-24-14-19-18-13(10-5-4-8-23-10)20(14)7-6-11(16)21/h4-5,8H,6-7,9H2,1-3H3,(H2,16,21)(H,17,22)