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

Systemtic Name: (5E)-2-[4-(4-chlorophenyl)piperazin-1-yl]-5-[(3-nitrophenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5E)-2-[4-(4-chlorophenyl)piperazin-1-yl]-5-[(3-nitrophenyl)methylene]thiazol-4-one CAS Name: (5E)-2-[4-(4-chlorophenyl)-1-piperazinyl]-5-[(3-nitrophenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-[4-(4-chlorophenyl)piperazin-1-yl]-5-[(3-nitrophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-[4-(4-chlorophenyl)piperazino]-5-(3-nitrobenzylidene)-2-thiazolin-4-one Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NC(=O)C(=CC4=CC(=CC=C4)[N+](=O)[O-])S3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NC(=O)/C(=C\C4=CC(=CC=C4)[N+](=O)[O-])/S3

InChI

InChI=1S/C20H17ClN4O3S/c21-15-4-6-16(7-5-15)23-8-10-24(11-9-23)20-22-19(26)18(29-20)13-14-2-1-3-17(12-14)25(27)28/h1-7,12-13H,8-11H2/b18-13+