N-(ethylcarbamoyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N5O2S2/c1-3-14-12(20)16-11(19)8(2)22-13-15-10(17-18-13)7-9-5-4-6-21-9/h4-6,8H,3,7H2,1-2H3,(H,15,17,18)(H2,14,16,19,20)