4-chloranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-N-quinolin-8-yl-benzamide

Systemtic Name: 4-chloranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-N-quinolin-8-yl-benzamide Openeye Name: 4-chloro-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]-N-(8-quinolyl)benzamide CAS Name: 4-chloro-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-N-(8-quinolinyl)benzamide IUPAC Name: 4-chloro-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-N-quinolin-8-ylbenzamide Traditional Name: 4-chloro-3-[(3S)-3-methylpiperidino]sulfonyl-N-(8-quinolyl)benzamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC4=C3N=CC=C4)Cl

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC4=C3N=CC=C4)Cl

InChI

InChI=1S/C22H22ClN3O3S/c1-15-5-4-12-26(14-15)30(28,29)20-13-17(9-10-18(20)23)22(27)25-19-8-2-6-16-7-3-11-24-21(16)19/h2-3,6-11,13,15H,4-5,12,14H2,1H3,(H,25,27)/t15-/m0/s1