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

Systemtic Name: 3-[4-methyl-5-(4-oxidanylidene-4-thiophen-2-yl-butyl)sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[4-oxo-4-(2-thienyl)butyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[(4-oxo-4-thiophen-2-ylbutyl)thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-(4-oxo-4-thiophen-2-ylbutyl)sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[4-keto-4-(2-thienyl)butyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCC(=O)C2=CC=CS2)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCCCC(=O)C2=CC=CS2)CCC(=O)N

InChI

InChI=1S/C14H18N4O2S2/c1-18-13(7-6-12(15)20)16-17-14(18)22-9-2-4-10(19)11-5-3-8-21-11/h3,5,8H,2,4,6-7,9H2,1H3,(H2,15,20)