2-azanyl-5-[(5-nitro-2-propoxy-phenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[(5-nitro-2-propoxy-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[(5-nitro-2-propoxy-phenyl)methylene]thiazol-4-one CAS Name: 2-amino-5-[(5-nitro-2-propoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[(5-nitro-2-propoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-(5-nitro-2-propoxy-benzylidene)-2-thiazolin-4-one Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)[N+](=O)[O-])C=C2C(=O)N=C(S2)N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[N+](=O)[O-])C=C2C(=O)N=C(S2)N

InChI

InChI=1S/C13H13N3O4S/c1-2-5-20-10-4-3-9(16(18)19)6-8(10)7-11-12(17)15-13(14)21-11/h3-4,6-7H,2,5H2,1H3,(H2,14,15,17)