N-(3-ethoxypropylcarbamoyl)-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-ethoxypropylcarbamoyl)-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethoxypropylcarbamoyl)acetamide CAS Name: N-[(3-ethoxypropylamino)-oxomethyl]-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethoxypropylcarbamoyl)acetamide Traditional Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-ethoxypropylcarbamoyl)acetamide Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)NC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C

Isomeric SMILES

CCOCCCNC(=O)NC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C

InChI

InChI=1S/C18H25N5O3S/c1-3-26-11-7-10-19-17(25)20-16(24)13-27-18-22-21-14(2)23(18)12-15-8-5-4-6-9-15/h4-6,8-9H,3,7,10-13H2,1-2H3,(H2,19,20,24,25)