6-[2-(3-butylsulfonylpropylamino)-2,3-dihydro-1H-inden-5-yl]-2-(3-imidazol-1-ylpropyl)pyridazin-3-one

Systemtic Name: 6-[2-(3-butylsulfonylpropylamino)-2,3-dihydro-1H-inden-5-yl]-2-(3-imidazol-1-ylpropyl)pyridazin-3-one Openeye Name: 6-[2-(3-butylsulfonylpropylamino)indan-5-yl]-2-(3-imidazol-1-ylpropyl)pyridazin-3-one CAS Name: 6-[2-(3-butylsulfonylpropylamino)-2,3-dihydro-1H-inden-5-yl]-2-[3-(1-imidazolyl)propyl]-3-pyridazinone IUPAC Name: 6-[2-(3-butylsulfonylpropylamino)-2,3-dihydro-1H-inden-5-yl]-2-(3-imidazol-1-ylpropyl)pyridazin-3-one Traditional Name: 6-[2-(3-butylsulfonylpropylamino)indan-5-yl]-2-(3-imidazol-1-ylpropyl)pyridazin-3-one Formula: C26H35N5O3S MolecularWeight: 497.6528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CCCNC1CC2=C(C1)C=C(C=C2)C3=NN(C(=O)C=C3)CCCN4C=CN=C4

Isomeric SMILES

CCCCS(=O)(=O)CCCNC1CC2=C(C1)C=C(C=C2)C3=NN(C(=O)C=C3)CCCN4C=CN=C4

InChI

InChI=1S/C26H35N5O3S/c1-2-3-15-35(33,34)16-4-10-28-24-18-21-6-7-22(17-23(21)19-24)25-8-9-26(32)31(29-25)13-5-12-30-14-11-27-20-30/h6-9,11,14,17,20,24,28H,2-5,10,12-13,15-16,18-19H2,1H3