2-azanyl-5-[[3-iodanyl-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[[3-iodanyl-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[[3-iodo-4-[(4-nitrophenyl)methoxy]phenyl]methylene]thiazol-4-one CAS Name: 2-amino-5-[[3-iodo-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[[3-iodo-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[3-iodo-4-(4-nitrobenzyl)oxy-benzylidene]-2-thiazolin-4-one Formula: C17H12IN3O4S MolecularWeight: 481.26435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=C(C=C(C=C2)C=C3C(=O)N=C(S3)N)I)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC2=C(C=C(C=C2)C=C3C(=O)N=C(S3)N)I)[N+](=O)[O-]

InChI

InChI=1S/C17H12IN3O4S/c18-13-7-11(8-15-16(22)20-17(19)26-15)3-6-14(13)25-9-10-1-4-12(5-2-10)21(23)24/h1-8H,9H2,(H2,19,20,22)