dimethyl (2Z)-2-[1-(phenylmethyl)-3-propan-2-yl-imidazol-2-ylidene]-3-sulfanylidene-butanedioate

Systemtic Name: dimethyl (2Z)-2-[1-(phenylmethyl)-3-propan-2-yl-imidazol-2-ylidene]-3-sulfanylidene-butanedioate Openeye Name: dimethyl (2Z)-2-(1-benzyl-3-isopropyl-imidazol-2-ylidene)-3-thioxo-butanedioate CAS Name: (2Z)-2-[1-(phenylmethyl)-3-propan-2-yl-2-imidazolylidene]-3-sulfanylidenebutanedioic acid dimethyl ester IUPAC Name: dimethyl (2Z)-2-(1-benzyl-3-propan-2-ylimidazol-2-ylidene)-3-sulfanylidenebutanedioate Traditional Name: (2Z)-2-(1-benzyl-3-isopropyl-4-imidazolin-2-ylidene)-3-thioxo-succinic acid dimethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CN(C1=C(C(=S)C(=O)OC)C(=O)OC)CC2=CC=CC=C2

Isomeric SMILES

CC(C)N\1C=CN(/C1=C(/C(=S)C(=O)OC)\C(=O)OC)CC2=CC=CC=C2

InChI

InChI=1S/C19H22N2O4S/c1-13(2)21-11-10-20(12-14-8-6-5-7-9-14)17(21)15(18(22)24-3)16(26)19(23)25-4/h5-11,13H,12H2,1-4H3/b17-15+