4-phenylsulfanyl-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butanamide

Systemtic Name: 4-phenylsulfanyl-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butanamide Openeye Name: 4-phenylsulfanyl-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butanamide CAS Name: 4-(phenylthio)-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butanamide IUPAC Name: 4-phenylsulfanyl-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butanamide Traditional Name: 4-(phenylthio)-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butyramide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C18H18N4OS/c23-16(12-7-13-24-15-10-5-2-6-11-15)19-18-20-17(21-22-18)14-8-3-1-4-9-14/h1-6,8-11H,7,12-13H2,(H2,19,20,21,22,23)