3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-oxidanylidene-pentan-2-yl)propanamide

Systemtic Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-oxidanylidene-pentan-2-yl)propanamide Openeye Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1,1-dimethyl-3-oxo-butyl)propanamide CAS Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-methyl-4-oxopentan-2-yl)propanamide IUPAC Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-oxopentan-2-yl)propanamide Traditional Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-N-(3-keto-1,1-dimethyl-butyl)propionamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)NC(=O)CCSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CC(C)(C)NC(=O)CCSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O2S/c1-14(25)13-20(2,3)22-17(26)11-12-27-19-21-18(15-9-10-15)24(23-19)16-7-5-4-6-8-16/h4-8,15H,9-13H2,1-3H3,(H,22,26)