N'-[2-[(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-3-nitro-benzohydrazide

Systemtic Name: N'-[2-[(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-3-nitro-benzohydrazide Openeye Name: N'-[2-[(5-morpholino-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-3-nitro-benzohydrazide CAS Name: N'-[2-[[5-(4-morpholinyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-3-nitrobenzohydrazide IUPAC Name: N'-[2-[(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-3-nitrobenzohydrazide Traditional Name: N'-[2-[(5-morpholino-4-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-3-nitro-benzohydrazide Formula: C21H21N7O5S MolecularWeight: 483.50034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N7O5S/c29-18(22-23-19(30)15-5-4-8-17(13-15)28(31)32)14-34-21-25-24-20(26-9-11-33-12-10-26)27(21)16-6-2-1-3-7-16/h1-8,13H,9-12,14H2,(H,22,29)(H,23,30)