2-[[6-(4-phenylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-chromen-2-yl]methylamino]-1-pyridin-3-yl-ethanol

Systemtic Name: 2-[[6-(4-phenylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-chromen-2-yl]methylamino]-1-pyridin-3-yl-ethanol Openeye Name: 2-[[6-(4-phenylpiperazin-1-yl)sulfonylchroman-2-yl]methylamino]-1-(3-pyridyl)ethanol CAS Name: 2-[[6-[(4-phenyl-1-piperazinyl)sulfonyl]-3,4-dihydro-2H-1-benzopyran-2-yl]methylamino]-1-(3-pyridinyl)ethanol IUPAC Name: 2-[[6-(4-phenylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-chromen-2-yl]methylamino]-1-pyridin-3-ylethanol Traditional Name: 2-[[6-(4-phenylpiperazino)sulfonylchroman-2-yl]methylamino]-1-(3-pyridyl)ethanol Formula: C27H32N4O4S MolecularWeight: 508.63238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)OC1CNCC(C5=CN=CC=C5)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)OC1CNCC(C5=CN=CC=C5)O

InChI

InChI=1S/C27H32N4O4S/c32-26(22-5-4-12-28-18-22)20-29-19-24-9-8-21-17-25(10-11-27(21)35-24)36(33,34)31-15-13-30(14-16-31)23-6-2-1-3-7-23/h1-7,10-12,17-18,24,26,29,32H,8-9,13-16,19-20H2