4-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-methylsulfanyl-1-[[3-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-(methylthio)-1-oxo-1-[3-(2-oxo-1-pyrrolidinyl)anilino]butan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-methylsulfanyl-1-oxo-1-[3-(2-oxopyrrolidin-1-yl)anilino]butan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[1-[[3-(2-ketopyrrolidino)phenyl]carbamoyl]-3-(methylthio)propyl]-3-nitro-benzamide Formula: C22H23ClN4O5S MolecularWeight: 490.95982

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=CC(=C1)N2CCCC2=O)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NC1=CC=CC(=C1)N2CCCC2=O)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H23ClN4O5S/c1-33-11-9-18(25-21(29)14-7-8-17(23)19(12-14)27(31)32)22(30)24-15-4-2-5-16(13-15)26-10-3-6-20(26)28/h2,4-5,7-8,12-13,18H,3,6,9-11H2,1H3,(H,24,30)(H,25,29)