4-[(7-bromanyl-2H-chromen-3-yl)sulfonyl]-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one dihydrochloride

Systemtic Name: 4-[(7-bromanyl-2H-chromen-3-yl)sulfonyl]-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one dihydrochloride Openeye Name: 4-[(7-bromo-2H-chromen-3-yl)sulfonyl]-1-[[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one dihydrochloride CAS Name: 4-[(7-bromo-2H-1-benzopyran-3-yl)sulfonyl]-1-[(1-pyridin-4-yl-4-piperidinyl)amino]-2-piperazinone dihydrochloride IUPAC Name: 4-[(7-bromo-2H-chromen-3-yl)sulfonyl]-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one dihydrochloride Traditional Name: 4-[(7-bromo-2H-chromen-3-yl)sulfonyl]-1-[[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one dihydrochloride Formula: C23H28BrCl2N5O4S MolecularWeight: 621.37452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C(C=C4)Br)OC3)C5=CC=NC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCC1NN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C(C=C4)Br)OC3)C5=CC=NC=C5.Cl.Cl

InChI

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