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

Systemtic Name: 4-chloranyl-2-[(1R,3S)-3-(ethylamino)-4-oxidanyl-1-(1,3-thiazol-2-yl)butoxy]-5-fluoranyl-benzenecarbonitrile Openeye Name: 4-chloro-2-[(1R,3S)-3-(ethylamino)-4-hydroxy-1-thiazol-2-yl-butoxy]-5-fluoro-benzonitrile CAS Name: 4-chloro-2-[(1R,3S)-3-(ethylamino)-4-hydroxy-1-(2-thiazolyl)butoxy]-5-fluorobenzonitrile IUPAC Name: 4-chloro-2-[(1R,3S)-3-(ethylamino)-4-hydroxy-1-(1,3-thiazol-2-yl)butoxy]-5-fluorobenzonitrile Traditional Name: 4-chloro-2-[(1R,3S)-3-(ethylamino)-4-hydroxy-1-thiazol-2-yl-butoxy]-5-fluoro-benzonitrile Formula: C16H17ClFN3O2S MolecularWeight: 369.841483

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(CC(C1=NC=CS1)OC2=CC(=C(C=C2C#N)F)Cl)CO

Isomeric SMILES

CCN[C@@H](C[C@H](C1=NC=CS1)OC2=CC(=C(C=C2C#N)F)Cl)CO

InChI

InChI=1S/C16H17ClFN3O2S/c1-2-20-11(9-22)6-15(16-21-3-4-24-16)23-14-7-12(17)13(18)5-10(14)8-19/h3-5,7,11,15,20,22H,2,6,9H2,1H3/t11-,15+/m0/s1