N-aminocarbonyl-3-methyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]butanamide

Systemtic Name: N-aminocarbonyl-3-methyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: N-carbamoyl-3-methyl-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N-carbamoyl-3-methyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: N-carbamoyl-3-methyl-2-[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]butyramide Formula: C13H17N5O2S2 MolecularWeight: 339.43638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NNC(=N1)CC2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=NNC(=N1)CC2=CC=CS2

InChI

InChI=1S/C13H17N5O2S2/c1-7(2)10(11(19)16-12(14)20)22-13-15-9(17-18-13)6-8-4-3-5-21-8/h3-5,7,10H,6H2,1-2H3,(H,15,17,18)(H3,14,16,19,20)