(4E)-4-(2-cyclopropyl-6-iodanyl-thiopyran-4-ylidene)-3-phenyl-1,2-oxazol-5-one

Systemtic Name: (4E)-4-(2-cyclopropyl-6-iodanyl-thiopyran-4-ylidene)-3-phenyl-1,2-oxazol-5-one Openeye Name: (4E)-4-(2-cyclopropyl-6-iodo-thiopyran-4-ylidene)-3-phenyl-isoxazol-5-one CAS Name: (4E)-4-(2-cyclopropyl-6-iodo-4-thiopyranylidene)-3-phenyl-5-isoxazolone IUPAC Name: (4E)-4-(2-cyclopropyl-6-iodothiopyran-4-ylidene)-3-phenyl-1,2-oxazol-5-one Traditional Name: (4E)-4-(2-cyclopropyl-6-iodo-thiopyran-4-ylidene)-3-phenyl-2-isoxazolin-5-one Formula: C17H12INO2S MolecularWeight: 421.25215

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=C3C(=NOC3=O)C4=CC=CC=C4)C=C(S2)I

Isomeric SMILES

C1CC1C2=C/C(=C\3/C(=NOC3=O)C4=CC=CC=C4)/C=C(S2)I

InChI

InChI=1S/C17H12INO2S/c18-14-9-12(8-13(22-14)10-6-7-10)15-16(19-21-17(15)20)11-4-2-1-3-5-11/h1-5,8-10H,6-7H2/b15-12+