N-(3-chloranyl-4-methyl-phenyl)-1-quinolin-8-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-quinolin-8-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-(8-quinolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-(8-quinolinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-quinolin-8-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-1-(8-quinolylsulfonyl)isonipecotamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)Cl

InChI

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