N-(2-bromophenyl)-2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetamide CAS Name: N-(2-bromophenyl)-2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]thio]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetamide Traditional Name: N-(2-bromophenyl)-2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]thio]acetamide Formula: C19H18BrN3OS MolecularWeight: 416.33472

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3Br)C#N

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3Br)C#N

InChI

InChI=1S/C19H18BrN3OS/c1-12-6-7-16-13(8-12)9-14(10-21)19(23-16)25-11-18(24)22-17-5-3-2-4-15(17)20/h2-5,9,12H,6-8,11H2,1H3,(H,22,24)/t12-/m0/s1