2-methoxy-4-methylsulfanyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-benzohydrazide

Systemtic Name: 2-methoxy-4-methylsulfanyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-benzohydrazide Openeye Name: 2-methoxy-4-methylsulfanyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)benzohydrazide CAS Name: 2-methoxy-4-(methylthio)-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]benzohydrazide IUPAC Name: 2-methoxy-4-methylsulfanyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)benzohydrazide Traditional Name: 2-methoxy-4-(methylthio)-N'-(4-pyrrolidinosulfonylbenzoyl)benzohydrazide Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23N3O5S2/c1-28-18-13-15(29-2)7-10-17(18)20(25)22-21-19(24)14-5-8-16(9-6-14)30(26,27)23-11-3-4-12-23/h5-10,13H,3-4,11-12H2,1-2H3,(H,21,24)(H,22,25)