N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(2-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(2-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-fluorophenyl)sulfanyl-acetamide CAS Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[(2-fluorophenyl)thio]acetamide IUPAC Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(2-fluorophenyl)sulfanylacetamide Traditional Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-[(2-fluorophenyl)thio]acetamide Formula: C18H17FN2OS2 MolecularWeight: 360.468783

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=CC=CC=C3F

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=CC=CC=C3F

InChI

InChI=1S/C18H17FN2OS2/c1-11-6-7-12-13(9-20)18(24-16(12)8-11)21-17(22)10-23-15-5-3-2-4-14(15)19/h2-5,11H,6-8,10H2,1H3,(H,21,22)/t11-/m0/s1