7-bromanyl-N-[2-oxidanylidene-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]pyrrolidin-3-yl]-2H-chromene-3-sulfonamide

Systemtic Name: 7-bromanyl-N-[2-oxidanylidene-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]pyrrolidin-3-yl]-2H-chromene-3-sulfonamide Openeye Name: 7-bromo-N-[2-oxo-1-[[1-(4-pyridyl)-4-piperidyl]amino]pyrrolidin-3-yl]-2H-chromene-3-sulfonamide CAS Name: 7-bromo-N-[2-oxo-1-[(1-pyridin-4-yl-4-piperidinyl)amino]-3-pyrrolidinyl]-2H-1-benzopyran-3-sulfonamide IUPAC Name: 7-bromo-N-[2-oxo-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]pyrrolidin-3-yl]-2H-chromene-3-sulfonamide Traditional Name: 7-bromo-N-[2-keto-1-[[1-(4-pyridyl)-4-piperidyl]amino]pyrrolidin-3-yl]-2H-chromene-3-sulfonamide Formula: C23H26BrN5O4S MolecularWeight: 548.45264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NN2CCC(C2=O)NS(=O)(=O)C3=CC4=C(C=C(C=C4)Br)OC3)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1NN2CCC(C2=O)NS(=O)(=O)C3=CC4=C(C=C(C=C4)Br)OC3)C5=CC=NC=C5

InChI

InChI=1S/C23H26BrN5O4S/c24-17-2-1-16-13-20(15-33-22(16)14-17)34(31,32)27-21-7-12-29(23(21)30)26-18-5-10-28(11-6-18)19-3-8-25-9-4-19/h1-4,8-9,13-14,18,21,26-27H,5-7,10-12,15H2