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

Systemtic Name: 2-chloranyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-(3-oxopiperazin-1-yl)phenyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[4-(3-oxo-1-piperazinyl)phenyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[4-(3-oxopiperazin-1-yl)phenyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(3-ketopiperazino)phenyl]-5-piperidinosulfonyl-benzamide Formula: C22H25ClN4O4S MolecularWeight: 476.9763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H25ClN4O4S/c23-20-9-8-18(32(30,31)27-11-2-1-3-12-27)14-19(20)22(29)25-16-4-6-17(7-5-16)26-13-10-24-21(28)15-26/h4-9,14H,1-3,10-13,15H2,(H,24,28)(H,25,29)