5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-2-(naphthalen-1-ylamino)-1,3-thiazol-4-one

Systemtic Name: 5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-2-(naphthalen-1-ylamino)-1,3-thiazol-4-one Openeye Name: 5-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-2-(1-naphthylamino)thiazol-4-one CAS Name: 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-2-(1-naphthalenylamino)-4-thiazolone IUPAC Name: 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-2-(naphthalen-1-ylamino)-1,3-thiazol-4-one Traditional Name: 5-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-2-(1-naphthylamino)-2-thiazolin-4-one Formula: C21H15N3O5S MolecularWeight: 421.4259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)N=C(S2)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)N=C(S2)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H15N3O5S/c1-29-17-10-12(9-16(19(17)25)24(27)28)11-18-20(26)23-21(30-18)22-15-8-4-6-13-5-2-3-7-14(13)15/h2-11,25H,1H3,(H,22,23,26)