1-(4-methoxyphenyl)-3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]imidazole-2-thione

Systemtic Name: 1-(4-methoxyphenyl)-3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]imidazole-2-thione Openeye Name: 1-(4-methoxyphenyl)-3-[[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methyl]imidazole-2-thione CAS Name: 1-(4-methoxyphenyl)-3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-2-imidazolethione IUPAC Name: 1-(4-methoxyphenyl)-3-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]imidazole-2-thione Traditional Name: 1-(4-methoxyphenyl)-3-[(4-tosyl-1,4-diazepan-1-yl)methyl]-4-imidazoline-2-thione Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CN3C=CN(C3=S)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CN3C=CN(C3=S)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H28N4O3S2/c1-19-4-10-22(11-5-19)32(28,29)26-13-3-12-24(14-16-26)18-25-15-17-27(23(25)31)20-6-8-21(30-2)9-7-20/h4-11,15,17H,3,12-14,16,18H2,1-2H3