2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)butanamide

Systemtic Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)butanamide Openeye Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methylisoxazol-3-yl)butanamide CAS Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(5-methyl-3-isoxazolyl)butanamide IUPAC Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)butanamide Traditional Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(5-methylisoxazol-3-yl)butyramide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=NN=C(N2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SC2=NN=C(N2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C19H21N5O2S/c1-3-15(18(25)20-16-11-12(2)26-23-16)27-19-22-21-17(13-9-10-13)24(19)14-7-5-4-6-8-14/h4-8,11,13,15H,3,9-10H2,1-2H3,(H,20,23,25)