(5Z)-5-[[3-butoxy-4-oxidanyl-5-(phenylmethyl)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-[[3-butoxy-4-oxidanyl-5-(phenylmethyl)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-[(3-benzyl-5-butoxy-4-hydroxy-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-[[3-butoxy-4-hydroxy-5-(phenylmethyl)phenyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-[(3-benzyl-5-butoxy-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-5-(3-benzyl-5-butoxy-4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one Formula: C21H21NO3S2 MolecularWeight: 399.52634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC(=C1O)CC2=CC=CC=C2)C=C3C(=O)NC(=S)S3

Isomeric SMILES

CCCCOC1=CC(=CC(=C1O)CC2=CC=CC=C2)/C=C\3/C(=O)NC(=S)S3

InChI

InChI=1S/C21H21NO3S2/c1-2-3-9-25-17-12-15(13-18-20(24)22-21(26)27-18)11-16(19(17)23)10-14-7-5-4-6-8-14/h4-8,11-13,23H,2-3,9-10H2,1H3,(H,22,24,26)/b18-13-