N,N-diethyl-4-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: N,N-diethyl-4-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N,N-diethyl-4-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: N,N-diethyl-4-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N,N-diethyl-4-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N,N-diethyl-4-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]butyramide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCSC1=NNC(=O)N1CCC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=O)CCCSC1=NNC(=O)N1CCC2=CC=CC=C2

InChI

InChI=1S/C18H26N4O2S/c1-3-21(4-2)16(23)11-8-14-25-18-20-19-17(24)22(18)13-12-15-9-6-5-7-10-15/h5-7,9-10H,3-4,8,11-14H2,1-2H3,(H,19,24)