4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide Openeye Name: 4-chloro-3-[(3-methyl-1-piperidyl)sulfonyl]-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide CAS Name: 4-chloro-3-[(3-methyl-1-piperidinyl)sulfonyl]-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]benzamide IUPAC Name: 4-chloro-3-(3-methylpiperidin-1-yl)sulfonyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]benzamide Traditional Name: 4-chloro-N-[6-(3-ketopiperazino)-3-pyridyl]-3-(3-methylpiperidino)sulfonyl-benzamide Formula: C22H26ClN5O4S MolecularWeight: 491.99094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4)Cl

InChI

InChI=1S/C22H26ClN5O4S/c1-15-3-2-9-28(13-15)33(31,32)19-11-16(4-6-18(19)23)22(30)26-17-5-7-20(25-12-17)27-10-8-24-21(29)14-27/h4-7,11-12,15H,2-3,8-10,13-14H2,1H3,(H,24,29)(H,26,30)