3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: 3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-3-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: N-(benzylcarbamoyl)-3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(benzylcarbamoyl)-3-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)NC(=O)NCC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)NC(=O)NCC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C19H21N5O2S2/c1-2-24-17(15-9-6-11-27-15)22-23-19(24)28-12-10-16(25)21-18(26)20-13-14-7-4-3-5-8-14/h3-9,11H,2,10,12-13H2,1H3,(H2,20,21,25,26)