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

Systemtic Name: 1-(4-methoxyphenyl)-3-[(4-methylsulfonyl-1,4-diazepan-1-yl)methyl]imidazole-2-thione Openeye Name: 1-(4-methoxyphenyl)-3-[(4-methylsulfonyl-1,4-diazepan-1-yl)methyl]imidazole-2-thione CAS Name: 1-(4-methoxyphenyl)-3-[(4-methylsulfonyl-1,4-diazepan-1-yl)methyl]-2-imidazolethione IUPAC Name: 1-(4-methoxyphenyl)-3-[(4-methylsulfonyl-1,4-diazepan-1-yl)methyl]imidazole-2-thione Traditional Name: 1-[(4-mesyl-1,4-diazepan-1-yl)methyl]-3-(4-methoxyphenyl)-4-imidazoline-2-thione Formula: C17H24N4O3S2 MolecularWeight: 396.52746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=CN(C2=S)CN3CCCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N2C=CN(C2=S)CN3CCCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C17H24N4O3S2/c1-24-16-6-4-15(5-7-16)21-13-11-19(17(21)25)14-18-8-3-9-20(12-10-18)26(2,22)23/h4-7,11,13H,3,8-10,12,14H2,1-2H3