N-(2-bromophenyl)-2-(3-cyano-6-propan-2-yl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-bromophenyl)-2-(3-cyano-6-propan-2-yl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-bromophenyl)-2-[(3-cyano-6-isopropyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-bromophenyl)-2-[(3-cyano-6-propan-2-yl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-bromophenyl)-2-(3-cyano-6-propan-2-ylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-bromophenyl)-2-[(3-cyano-6-isopropyl-2-quinolyl)thio]acetamide Formula: C21H18BrN3OS MolecularWeight: 440.35612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C21H18BrN3OS/c1-13(2)14-7-8-18-15(9-14)10-16(11-23)21(25-18)27-12-20(26)24-19-6-4-3-5-17(19)22/h3-10,13H,12H2,1-2H3,(H,24,26)