N-(phenylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: N-(phenylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N-benzyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: N-(phenylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N-benzyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-benzyl-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]butyramide Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4OS/c1-2-17(18(24)20-13-15-9-5-3-6-10-15)25-19-21-14-23(22-19)16-11-7-4-8-12-16/h3-12,14,17H,2,13H2,1H3,(H,20,24)