2-[[1-(3-acetamidophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-aminocarbonyl-propanamide

Systemtic Name: 2-[[1-(3-acetamidophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-aminocarbonyl-propanamide Openeye Name: 2-[1-(3-acetamidophenyl)tetrazol-5-yl]sulfanyl-N-carbamoyl-propanamide CAS Name: 2-[[1-(3-acetamidophenyl)-5-tetrazolyl]thio]-N-carbamoylpropanamide IUPAC Name: 2-[1-(3-acetamidophenyl)tetrazol-5-yl]sulfanyl-N-carbamoylpropanamide Traditional Name: 2-[[1-(3-acetamidophenyl)tetrazol-5-yl]thio]-N-carbamoyl-propionamide Formula: C13H15N7O3S MolecularWeight: 349.3683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=NN1C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=NN1C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C13H15N7O3S/c1-7(11(22)16-12(14)23)24-13-17-18-19-20(13)10-5-3-4-9(6-10)15-8(2)21/h3-7H,1-2H3,(H,15,21)(H3,14,16,22,23)