(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-2-[(phenylmethyl)amino]-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-2-[(phenylmethyl)amino]-1,3-thiazol-4-one Openeye Name: (5E)-2-(benzylamino)-5-[[5-(3-nitrophenyl)-2-furyl]methylene]thiazol-4-one CAS Name: (5E)-5-[[5-(3-nitrophenyl)-2-furanyl]methylidene]-2-[(phenylmethyl)amino]-4-thiazolone IUPAC Name: (5E)-2-(benzylamino)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-(benzylamino)-5-[[5-(3-nitrophenyl)-2-furyl]methylene]-2-thiazolin-4-one Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])S2

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=O)/C(=C\C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])/S2

InChI

InChI=1S/C21H15N3O4S/c25-20-19(29-21(23-20)22-13-14-5-2-1-3-6-14)12-17-9-10-18(28-17)15-7-4-8-16(11-15)24(26)27/h1-12H,13H2,(H,22,23,25)/b19-12+