5,5-dimethyl-1-[6-[4-(3-methylsulfonylphenyl)piperazin-1-yl]hexyl]-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 5,5-dimethyl-1-[6-[4-(3-methylsulfonylphenyl)piperazin-1-yl]hexyl]-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: 5,5-dimethyl-1-[6-[4-(3-methylsulfonylphenyl)piperazin-1-yl]hexyl]-3-(1-oxo-3H-isobenzofuran-5-yl)-2-thioxo-imidazolidin-4-one CAS Name: 5,5-dimethyl-1-[6-[4-(3-methylsulfonylphenyl)-1-piperazinyl]hexyl]-3-(1-oxo-3H-isobenzofuran-5-yl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: 5,5-dimethyl-1-[6-[4-(3-methylsulfonylphenyl)piperazin-1-yl]hexyl]-3-(1-oxo-3H-2-benzofuran-5-yl)-2-sulfanylideneimidazolidin-4-one Traditional Name: 3-(1-ketophthalan-5-yl)-1-[6-[4-(3-mesylphenyl)piperazino]hexyl]-5,5-dimethyl-2-thioxo-4-imidazolidinone Formula: C30H38N4O5S2 MolecularWeight: 598.77652

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCCCCN2CCN(CC2)C3=CC(=CC=C3)S(=O)(=O)C)C4=CC5=C(C=C4)C(=O)OC5)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCCCCN2CCN(CC2)C3=CC(=CC=C3)S(=O)(=O)C)C4=CC5=C(C=C4)C(=O)OC5)C

InChI

InChI=1S/C30H38N4O5S2/c1-30(2)28(36)34(24-11-12-26-22(19-24)21-39-27(26)35)29(40)33(30)14-7-5-4-6-13-31-15-17-32(18-16-31)23-9-8-10-25(20-23)41(3,37)38/h8-12,19-20H,4-7,13-18,21H2,1-3H3