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

Systemtic Name: N-(tert-butylcarbamoyl)-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(tert-butylcarbamoyl)propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(tert-butylcarbamoyl)propanamide Traditional Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(tert-butylcarbamoyl)propionamide Formula: C19H27N5O2S MolecularWeight: 389.51498

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC(=O)NC(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)NC(=O)NC(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C19H27N5O2S/c1-6-24-15(12-14-10-8-7-9-11-14)22-23-18(24)27-13(2)16(25)20-17(26)21-19(3,4)5/h7-11,13H,6,12H2,1-5H3,(H2,20,21,25,26)