butyl (3Z)-6-methyl-2,4-bis(oxidanylidene)-3-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]hept-5-enoate

Systemtic Name: butyl (3Z)-6-methyl-2,4-bis(oxidanylidene)-3-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]hept-5-enoate Openeye Name: butyl (3Z)-6-methyl-2,4-dioxo-3-[(2-thioxo-3H-benzimidazol-1-yl)methylene]hept-5-enoate CAS Name: (3Z)-6-methyl-2,4-dioxo-3-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-5-heptenoic acid butyl ester IUPAC Name: butyl (3Z)-6-methyl-2,4-dioxo-3-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]hept-5-enoate Traditional Name: (3Z)-2,4-diketo-6-methyl-3-[(2-thioxo-3H-benzimidazol-1-yl)methylene]hept-5-enoic acid butyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=O)C(=CN1C2=CC=CC=C2NC1=S)C(=O)C=C(C)C

Isomeric SMILES

CCCCOC(=O)C(=O)/C(=C\N1C2=CC=CC=C2NC1=S)/C(=O)C=C(C)C

InChI

InChI=1S/C20H22N2O4S/c1-4-5-10-26-19(25)18(24)14(17(23)11-13(2)3)12-22-16-9-7-6-8-15(16)21-20(22)27/h6-9,11-12H,4-5,10H2,1-3H3,(H,21,27)/b14-12-