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

Systemtic Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide Openeye Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide CAS Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]thio]-N-propylpropanamide IUPAC Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propylpropanamide Traditional Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]thio]-N-propyl-propionamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O2S/c1-4-8-17-15(23)11(2)24-16-20-18-10-21(16)14-7-5-6-13(9-14)19-12(3)22/h5-7,9-11H,4,8H2,1-3H3,(H,17,23)(H,19,22)