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

Systemtic Name: 2-[4-(4-methylphenyl)piperazin-1-yl]-5-[(2-nitrophenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 5-[(2-nitrophenyl)methylene]-2-[4-(p-tolyl)piperazin-1-yl]thiazol-4-one CAS Name: 2-[4-(4-methylphenyl)-1-piperazinyl]-5-[(2-nitrophenyl)methylidene]-4-thiazolone IUPAC Name: 2-[4-(4-methylphenyl)piperazin-1-yl]-5-[(2-nitrophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 5-(2-nitrobenzylidene)-2-[4-(p-tolyl)piperazino]-2-thiazolin-4-one Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C3=NC(=O)C(=CC4=CC=CC=C4[N+](=O)[O-])S3

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C3=NC(=O)C(=CC4=CC=CC=C4[N+](=O)[O-])S3

InChI

InChI=1S/C21H20N4O3S/c1-15-6-8-17(9-7-15)23-10-12-24(13-11-23)21-22-20(26)19(29-21)14-16-4-2-3-5-18(16)25(27)28/h2-9,14H,10-13H2,1H3