2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-[1-methyl-4-[[3-(propan-2-ylamino)pyridin-2-yl]amino]piperidin-2-yl]carbonyl-1H-indol-5-yl]ethanesulfonamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-[1-methyl-4-[[3-(propan-2-ylamino)pyridin-2-yl]amino]piperidin-2-yl]carbonyl-1H-indol-5-yl]ethanesulfonamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-[2-[4-[[3-(isopropylamino)-2-pyridyl]amino]-1-methyl-piperidine-2-carbonyl]-1H-indol-5-yl]ethanesulfonamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[2-[[1-methyl-4-[[3-(propan-2-ylamino)-2-pyridinyl]amino]-2-piperidinyl]-oxomethyl]-1H-indol-5-yl]ethanesulfonamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-[2-[1-methyl-4-[[3-(propan-2-ylamino)pyridin-2-yl]amino]piperidine-2-carbonyl]-1H-indol-5-yl]ethanesulfonamide Traditional Name: N-[2-[4-[[3-(isopropylamino)-2-pyridyl]amino]-1-methyl-pipecoloyl]-1H-indol-5-yl]-2-phthalimido-ethanesulfonamide Formula: C33H37N7O5S MolecularWeight: 643.75578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N=CC=C1)NC2CCN(C(C2)C(=O)C3=CC4=C(N3)C=CC(=C4)NS(=O)(=O)CCN5C(=O)C6=CC=CC=C6C5=O)C

Isomeric SMILES

CC(C)NC1=C(N=CC=C1)NC2CCN(C(C2)C(=O)C3=CC4=C(N3)C=CC(=C4)NS(=O)(=O)CCN5C(=O)C6=CC=CC=C6C5=O)C

InChI

InChI=1S/C33H37N7O5S/c1-20(2)35-27-9-6-13-34-31(27)36-22-12-14-39(3)29(19-22)30(41)28-18-21-17-23(10-11-26(21)37-28)38-46(44,45)16-15-40-32(42)24-7-4-5-8-25(24)33(40)43/h4-11,13,17-18,20,22,29,35,37-38H,12,14-16,19H2,1-3H3,(H,34,36)