N'-(3-methylsulfanylpropanoyl)-4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]benzohydrazide

Systemtic Name: N'-(3-methylsulfanylpropanoyl)-4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]benzohydrazide Openeye Name: N'-(3-methylsulfanylpropanoyl)-4-[(5-phenyltetrazol-2-yl)methyl]benzohydrazide CAS Name: N'-[3-(methylthio)-1-oxopropyl]-4-[(5-phenyl-2-tetrazolyl)methyl]benzohydrazide IUPAC Name: N'-(3-methylsulfanylpropanoyl)-4-[(5-phenyltetrazol-2-yl)methyl]benzohydrazide Traditional Name: N'-[3-(methylthio)propanoyl]-4-[(5-phenyltetrazol-2-yl)methyl]benzohydrazide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NNC(=O)C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CSCCC(=O)NNC(=O)C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N6O2S/c1-28-12-11-17(26)20-22-19(27)16-9-7-14(8-10-16)13-25-23-18(21-24-25)15-5-3-2-4-6-15/h2-10H,11-13H2,1H3,(H,20,26)(H,22,27)