2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(propylcarbamoyl)ethanamide

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(propylcarbamoyl)ethanamide Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(propylcarbamoyl)acetamide CAS Name: N-[oxo(propylamino)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(propylcarbamoyl)acetamide Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]-N-(propylcarbamoyl)acetamide Formula: C13H16N6O2S MolecularWeight: 320.37014

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)CSC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)NC(=O)CSC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C13H16N6O2S/c1-2-8-14-12(21)15-11(20)9-22-13-16-17-18-19(13)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,14,15,20,21)