2-chloranyl-N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[3-chloro-4-(3-ketopiperazino)phenyl]-5-pyrrolidinosulfonyl-benzamide Formula: C21H22Cl2N4O4S MolecularWeight: 497.39478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

InChI

InChI=1S/C21H22Cl2N4O4S/c22-17-5-4-15(32(30,31)27-8-1-2-9-27)12-16(17)21(29)25-14-3-6-19(18(23)11-14)26-10-7-24-20(28)13-26/h3-6,11-12H,1-2,7-10,13H2,(H,24,28)(H,25,29)