5-(3-azanyl-1-thiophen-3-yl-propyl)-4-chloranyl-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 5-(3-azanyl-1-thiophen-3-yl-propyl)-4-chloranyl-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-[3-amino-1-(3-thienyl)propyl]-4-chloro-3-fluoro-6-oxo-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 5-[3-amino-1-(3-thiophenyl)propyl]-4-chloro-3-fluoro-6-oxo-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 5-(3-amino-1-thiophen-3-ylpropyl)-4-chloro-3-fluoro-6-oxocyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-[3-amino-1-(3-thienyl)propyl]-4-chloro-3-fluoro-6-keto-cyclohexa-1,3-diene-1-carbonitrile Formula: C14H12ClFN2OS MolecularWeight: 310.774283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C(CCN)C2C(=C(C=C(C2=O)C#N)F)Cl

Isomeric SMILES

C1=CSC=C1C(CCN)C2C(=C(C=C(C2=O)C#N)F)Cl

InChI

InChI=1S/C14H12ClFN2OS/c15-13-11(16)5-9(6-18)14(19)12(13)10(1-3-17)8-2-4-20-7-8/h2,4-5,7,10,12H,1,3,17H2