(5Z)-2-[(2-methylphenyl)amino]-5-[(3-nitro-4-propan-2-yl-phenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: (5Z)-2-[(2-methylphenyl)amino]-5-[(3-nitro-4-propan-2-yl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-5-[(4-isopropyl-3-nitro-phenyl)methylene]-2-(2-methylanilino)thiazol-4-one CAS Name: (5Z)-2-(2-methylanilino)-5-[(3-nitro-4-propan-2-ylphenyl)methylidene]-4-thiazolone IUPAC Name: (5Z)-2-(2-methylanilino)-5-[(3-nitro-4-propan-2-ylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-5-(4-isopropyl-3-nitro-benzylidene)-2-(o-toluidino)-2-thiazolin-4-one Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=O)C(=CC3=CC(=C(C=C3)C(C)C)[N+](=O)[O-])S2

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=O)/C(=C/C3=CC(=C(C=C3)C(C)C)[N+](=O)[O-])/S2

InChI

InChI=1S/C20H19N3O3S/c1-12(2)15-9-8-14(10-17(15)23(25)26)11-18-19(24)22-20(27-18)21-16-7-5-4-6-13(16)3/h4-12H,1-3H3,(H,21,22,24)/b18-11-