2-[(1R,3S)-3-azanyl-1-(4-chloranylthiophen-2-yl)-4-oxidanyl-butoxy]-4-chloranyl-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(1R,3S)-3-azanyl-1-(4-chloranylthiophen-2-yl)-4-oxidanyl-butoxy]-4-chloranyl-5-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(1R,3S)-3-amino-1-(4-chloro-2-thienyl)-4-hydroxy-butoxy]-4-chloro-5-fluoro-benzonitrile CAS Name: 2-[(1R,3S)-3-amino-1-(4-chloro-2-thiophenyl)-4-hydroxybutoxy]-4-chloro-5-fluorobenzonitrile IUPAC Name: 2-[(1R,3S)-3-amino-1-(4-chlorothiophen-2-yl)-4-hydroxybutoxy]-4-chloro-5-fluorobenzonitrile Traditional Name: 2-[(1R,3S)-3-amino-1-(4-chloro-2-thienyl)-4-hydroxy-butoxy]-4-chloro-5-fluoro-benzonitrile Formula: C15H13Cl2FN2O2S MolecularWeight: 375.245323

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1F)Cl)OC(CC(CO)N)C2=CC(=CS2)Cl)C#N

Isomeric SMILES

C1=C(C(=CC(=C1F)Cl)O[C@H](C[C@@H](CO)N)C2=CC(=CS2)Cl)C#N

InChI

InChI=1S/C15H13Cl2FN2O2S/c16-9-2-15(23-7-9)14(3-10(20)6-21)22-13-4-11(17)12(18)1-8(13)5-19/h1-2,4,7,10,14,21H,3,6,20H2/t10-,14+/m0/s1