2-[(4-chlorophenyl)methylsulfanyl]-4-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-5-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-4-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-5-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-4-[[5-(4-nitrophenyl)-2-furyl]methylene]thiazol-5-one CAS Name: 2-[(4-chlorophenyl)methylthio]-4-[[5-(4-nitrophenyl)-2-furanyl]methylidene]-5-thiazolone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-4-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-5-one Traditional Name: 2-[(4-chlorobenzyl)thio]-4-[[5-(4-nitrophenyl)-2-furyl]methylene]-2-thiazolin-5-one Formula: C21H13ClN2O4S2 MolecularWeight: 456.92192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC(=CC3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)S2)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC(=CC3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)S2)Cl

InChI

InChI=1S/C21H13ClN2O4S2/c22-15-5-1-13(2-6-15)12-29-21-23-18(20(25)30-21)11-17-9-10-19(28-17)14-3-7-16(8-4-14)24(26)27/h1-11H,12H2