2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide

Systemtic Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)propionamide Formula: C15H18N6O3S MolecularWeight: 362.40682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NN=CN1C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

CC(C(=O)NC(=O)NC)SC1=NN=CN1C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C15H18N6O3S/c1-9(13(23)19-14(24)16-3)25-15-20-17-8-21(15)12-6-4-5-11(7-12)18-10(2)22/h4-9H,1-3H3,(H,18,22)(H2,16,19,23,24)