6-chloranyl-2-methyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-quinoline-3-carbohydrazide

Systemtic Name: 6-chloranyl-2-methyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-quinoline-3-carbohydrazide Openeye Name: 6-chloro-2-methyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)quinoline-3-carbohydrazide CAS Name: 6-chloro-2-methyl-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-3-quinolinecarbohydrazide IUPAC Name: 6-chloro-2-methyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)quinoline-3-carbohydrazide Traditional Name: 6-chloro-2-methyl-N'-(4-pyrrolidinosulfonylbenzoyl)quinoline-3-carbohydrazide Formula: C22H21ClN4O4S MolecularWeight: 472.94454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H21ClN4O4S/c1-14-19(13-16-12-17(23)6-9-20(16)24-14)22(29)26-25-21(28)15-4-7-18(8-5-15)32(30,31)27-10-2-3-11-27/h4-9,12-13H,2-3,10-11H2,1H3,(H,25,28)(H,26,29)