(5Z)-3-(azepan-1-ium-1-ylmethyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-3-(azepan-1-ium-1-ylmethyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-3-(azepan-1-ium-1-ylmethyl)-5-[(3,4-dimethoxyphenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-3-(1-azepan-1-iumylmethyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-3-(azepan-1-ium-1-ylmethyl)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-(azepan-1-ium-1-ylmethyl)-2-thioxo-5-veratrylidene-thiazolidin-4-one Formula: C19H25N2O3S2+ MolecularWeight: 393.5434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C[NH+]3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)C[NH+]3CCCCCC3)OC

InChI

InChI=1S/C19H24N2O3S2/c1-23-15-8-7-14(11-16(15)24-2)12-17-18(22)21(19(25)26-17)13-20-9-5-3-4-6-10-20/h7-8,11-12H,3-6,9-10,13H2,1-2H3/p+1/b17-12-