2-butylsulfanylpyridine; (5Z)-5-[(4-dimethylaminophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 2-butylsulfanylpyridine; (5Z)-5-[(4-dimethylaminophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 2-butylsulfanylpyridine; (5Z)-5-[(4-dimethylaminophenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 2-(butylthio)pyridine; (5Z)-5-[(4-dimethylaminophenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 2-butylsulfanylpyridine; (5Z)-5-[(4-dimethylaminophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 2-(butylthio)pyridine; (5Z)-5-[4-(dimethylamino)benzylidene]-2-thioxo-thiazolidin-4-one Formula: C21H25N3OS3 MolecularWeight: 431.6377

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=CC=N1.CN(C)C1=CC=C(C=C1)C=C2C(=O)NC(=S)S2

Isomeric SMILES

CCCCSC1=CC=CC=N1.CN(C)C1=CC=C(C=C1)/C=C\2/C(=O)NC(=S)S2

InChI

InChI=1S/C12H12N2OS2.C9H13NS/c1-14(2)9-5-3-8(4-6-9)7-10-11(15)13-12(16)17-10;1-2-3-8-11-9-6-4-5-7-10-9/h3-7H,1-2H3,(H,13,15,16);4-7H,2-3,8H2,1H3/b10-7-;