5-[(4-methoxyphenyl)methylidene]-3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(4-methoxyphenyl)methylidene]-3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[(4-methoxyphenyl)methylene]-3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxo-butyl]-2-thioxo-thiazolidin-4-one CAS Name: 5-[(4-methoxyphenyl)methylidene]-3-[4-(4-methyl-1-piperazin-4-iumyl)-4-oxobutyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(4-methoxyphenyl)methylidene]-3-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxobutyl]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-[4-keto-4-(4-methylpiperazin-4-ium-1-yl)butyl]-5-p-anisylidene-2-thioxo-thiazolidin-4-one Formula: C20H26N3O3S2+ MolecularWeight: 420.56874

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)OC)SC2=S

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)OC)SC2=S

InChI

InChI=1S/C20H25N3O3S2/c1-21-10-12-22(13-11-21)18(24)4-3-9-23-19(25)17(28-20(23)27)14-15-5-7-16(26-2)8-6-15/h5-8,14H,3-4,9-13H2,1-2H3/p+1