4-(2-oxidanylidenechromen-6-yl)sulfonyl-1-[piperidin-4-yl(pyridin-4-yl)methyl]piperazin-2-one hydrochloride

Systemtic Name: 4-(2-oxidanylidenechromen-6-yl)sulfonyl-1-[piperidin-4-yl(pyridin-4-yl)methyl]piperazin-2-one hydrochloride Openeye Name: 4-(2-oxochromen-6-yl)sulfonyl-1-[4-piperidyl(4-pyridyl)methyl]piperazin-2-one hydrochloride CAS Name: 4-[(2-oxo-1-benzopyran-6-yl)sulfonyl]-1-[4-piperidinyl(pyridin-4-yl)methyl]-2-piperazinone hydrochloride IUPAC Name: 4-(2-oxochromen-6-yl)sulfonyl-1-[piperidin-4-yl(pyridin-4-yl)methyl]piperazin-2-one hydrochloride Traditional Name: 4-(2-ketochromen-6-yl)sulfonyl-1-[4-piperidyl(4-pyridyl)methyl]piperazin-2-one hydrochloride Formula: C24H27ClN4O5S MolecularWeight: 519.01298

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)OC(=O)C=C5.Cl

Isomeric SMILES

C1CNCCC1C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)OC(=O)C=C5.Cl

InChI

InChI=1S/C24H26N4O5S.ClH/c29-22-16-27(34(31,32)20-2-3-21-19(15-20)1-4-23(30)33-21)13-14-28(22)24(17-5-9-25-10-6-17)18-7-11-26-12-8-18;/h1-6,9-10,15,18,24,26H,7-8,11-14,16H2;1H