N-methyl-2-[methyl-[2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]ethanamide

Systemtic Name: N-methyl-2-[methyl-[2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]ethanamide Openeye Name: N-methyl-2-[methyl-[2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-methyl-2-[methyl-[1-oxo-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]acetamide IUPAC Name: N-methyl-2-[methyl-[2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: 2-[[2-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]acetyl]-methyl-amino]-N-methyl-acetamide Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)C(=O)CSC1=NNC(=O)N1CCC2=CC=CC=C2

Isomeric SMILES

CNC(=O)CN(C)C(=O)CSC1=NNC(=O)N1CCC2=CC=CC=C2

InChI

InChI=1S/C16H21N5O3S/c1-17-13(22)10-20(2)14(23)11-25-16-19-18-15(24)21(16)9-8-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,17,22)(H,18,24)