N-(4-bromophenyl)-2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(3-cyano-7-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-(3-cyano-7-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[(3-cyano-7-methyl-2-quinolyl)thio]acetamide Formula: C19H14BrN3OS MolecularWeight: 412.30296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C19H14BrN3OS/c1-12-2-3-13-9-14(10-21)19(23-17(13)8-12)25-11-18(24)22-16-6-4-15(20)5-7-16/h2-9H,11H2,1H3,(H,22,24)