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

Systemtic Name: 2-[[1-(3-acetamidophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 2-[1-(3-acetamidophenyl)tetrazol-5-yl]sulfanyl-N-phenyl-propanamide CAS Name: 2-[[1-(3-acetamidophenyl)-5-tetrazolyl]thio]-N-phenylpropanamide IUPAC Name: 2-[1-(3-acetamidophenyl)tetrazol-5-yl]sulfanyl-N-phenylpropanamide Traditional Name: 2-[[1-(3-acetamidophenyl)tetrazol-5-yl]thio]-N-phenyl-propionamide Formula: C18H18N6O2S MolecularWeight: 382.43952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=NN2C3=CC(=CC=C3)NC(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)SC2=NN=NN2C3=CC(=CC=C3)NC(=O)C

InChI

InChI=1S/C18H18N6O2S/c1-12(17(26)20-14-7-4-3-5-8-14)27-18-21-22-23-24(18)16-10-6-9-15(11-16)19-13(2)25/h3-12H,1-2H3,(H,19,25)(H,20,26)