N-[5-iodanyl-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-pentan-2-yl]-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide

Systemtic Name: N-[5-iodanyl-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-pentan-2-yl]-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide Openeye Name: N-[4-iodo-1-(4-methylpiperidine-1-carbonyl)butyl]-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide CAS Name: N-[5-iodo-1-(4-methyl-1-piperidinyl)-1-oxopentan-2-yl]-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide IUPAC Name: N-[5-iodo-1-(4-methylpiperidin-1-yl)-1-oxopentan-2-yl]-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide Traditional Name: N-[4-iodo-1-(4-methylpiperidine-1-carbonyl)butyl]-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide Formula: C21H32IN3O3S MolecularWeight: 533.46655

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CCCI)NS(=O)(=O)C2=CC=CC3=C2NCC(C3)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CCCI)NS(=O)(=O)C2=CC=CC3=C2NCC(C3)C

InChI

InChI=1S/C21H32IN3O3S/c1-15-8-11-25(12-9-15)21(26)18(6-4-10-22)24-29(27,28)19-7-3-5-17-13-16(2)14-23-20(17)19/h3,5,7,15-16,18,23-24H,4,6,8-14H2,1-2H3