N-(6-methoxy-1,3-benzothiazol-2-yl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-(8-quinolylsulfonyl)piperidine-3-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-(8-quinolinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-quinolin-8-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-(8-quinolylsulfonyl)nipecotamide Formula: C23H22N4O4S2 MolecularWeight: 482.57518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C23H22N4O4S2/c1-31-17-9-10-18-19(13-17)32-23(25-18)26-22(28)16-7-4-12-27(14-16)33(29,30)20-8-2-5-15-6-3-11-24-21(15)20/h2-3,5-6,8-11,13,16H,4,7,12,14H2,1H3,(H,25,26,28)