1-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-3-(4-methoxyphenyl)imidazole-2-thione

Systemtic Name: 1-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-3-(4-methoxyphenyl)imidazole-2-thione Openeye Name: 1-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]-3-(4-methoxyphenyl)imidazole-2-thione CAS Name: 1-[[butyl-(1,1-dioxo-3-thiolanyl)amino]methyl]-3-(4-methoxyphenyl)-2-imidazolethione IUPAC Name: 1-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]-3-(4-methoxyphenyl)imidazole-2-thione Traditional Name: 1-[[butyl-(1,1-diketothiolan-3-yl)amino]methyl]-3-(4-methoxyphenyl)-4-imidazoline-2-thione Formula: C19H27N3O3S2 MolecularWeight: 409.56598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CN1C=CN(C1=S)C2=CC=C(C=C2)OC)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCCN(CN1C=CN(C1=S)C2=CC=C(C=C2)OC)C3CCS(=O)(=O)C3

InChI

InChI=1S/C19H27N3O3S2/c1-3-4-10-20(17-9-13-27(23,24)14-17)15-21-11-12-22(19(21)26)16-5-7-18(25-2)8-6-16/h5-8,11-12,17H,3-4,9-10,13-15H2,1-2H3