[3-imidazol-1-yl-1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] N,N-dimethylcarbamodithioate

Systemtic Name: [3-imidazol-1-yl-1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] N,N-dimethylcarbamodithioate Openeye Name: [1-(imidazol-1-ylmethyl)-2-(4-methoxyphenyl)-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [3-(1-imidazolyl)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [3-imidazol-1-yl-1-(4-methoxyphenyl)-1-oxopropan-2-yl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [1-(imidazol-1-ylmethyl)-2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C16H19N3O2S2 MolecularWeight: 349.47096

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SC(CN1C=CN=C1)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CN(C)C(=S)SC(CN1C=CN=C1)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H19N3O2S2/c1-18(2)16(22)23-14(10-19-9-8-17-11-19)15(20)12-4-6-13(21-3)7-5-12/h4-9,11,14H,10H2,1-3H3