N-[2-[methyl-(phenylmethyl)amino]ethyl]-2-oxidanylidene-6-piperidin-1-ylsulfonyl-1H-quinoline-4-carboxamide

Systemtic Name: N-[2-[methyl-(phenylmethyl)amino]ethyl]-2-oxidanylidene-6-piperidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Openeye Name: N-[2-[benzyl(methyl)amino]ethyl]-2-oxo-6-(1-piperidylsulfonyl)-1H-quinoline-4-carboxamide CAS Name: N-[2-[methyl-(phenylmethyl)amino]ethyl]-2-oxo-6-(1-piperidinylsulfonyl)-1H-quinoline-4-carboxamide IUPAC Name: N-[2-[benzyl(methyl)amino]ethyl]-2-oxo-6-piperidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Traditional Name: N-[2-[benzyl(methyl)amino]ethyl]-2-keto-6-piperidinosulfonyl-1H-quinoline-4-carboxamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CN(CCNC(=O)C1=CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4S/c1-28(18-19-8-4-2-5-9-19)15-12-26-25(31)22-17-24(30)27-23-11-10-20(16-21(22)23)34(32,33)29-13-6-3-7-14-29/h2,4-5,8-11,16-17H,3,6-7,12-15,18H2,1H3,(H,26,31)(H,27,30)