2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-N-[4-(1-phenoxypropan-2-ylamino)phenyl]-3,4-dihydro-2H-chromene-6-sulfonamide

Systemtic Name: 2-[[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]methyl]-N-[4-(1-phenoxypropan-2-ylamino)phenyl]-3,4-dihydro-2H-chromene-6-sulfonamide Openeye Name: 2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]-N-[4-[(1-methyl-2-phenoxy-ethyl)amino]phenyl]chromane-6-sulfonamide CAS Name: 2-[[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]methyl]-N-[4-(1-phenoxypropan-2-ylamino)phenyl]-3,4-dihydro-2H-1-benzopyran-6-sulfonamide IUPAC Name: 2-[[(2-hydroxy-2-pyridin-3-ylethyl)amino]methyl]-N-[4-(1-phenoxypropan-2-ylamino)phenyl]-3,4-dihydro-2H-chromene-6-sulfonamide Traditional Name: 2-[[[2-hydroxy-2-(3-pyridyl)ethyl]amino]methyl]-N-[4-[(1-methyl-2-phenoxy-ethyl)amino]phenyl]chroman-6-sulfonamide Formula: C32H36N4O5S MolecularWeight: 588.71704

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(CC4)CNCC(C5=CN=CC=C5)O

Isomeric SMILES

CC(COC1=CC=CC=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(CC4)CNCC(C5=CN=CC=C5)O

InChI

InChI=1S/C32H36N4O5S/c1-23(22-40-28-7-3-2-4-8-28)35-26-10-12-27(13-11-26)36-42(38,39)30-15-16-32-24(18-30)9-14-29(41-32)20-34-21-31(37)25-6-5-17-33-19-25/h2-8,10-13,15-19,23,29,31,34-37H,9,14,20-22H2,1H3