3-bromanyl-N-[2-[(6,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]phenyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[(6,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]phenyl]benzamide Openeye Name: 3-bromo-N-[2-[(6,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]phenyl]benzamide CAS Name: 3-bromo-N-[2-[(6,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylthio]phenyl]benzamide IUPAC Name: 3-bromo-N-[2-[(6,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]phenyl]benzamide Traditional Name: 3-bromo-N-[2-[(4-keto-6,8-dimethyl-1H-quinolin-2-yl)methylthio]phenyl]benzamide Formula: C25H21BrN2O2S MolecularWeight: 493.41544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C=C(N2)CSC3=CC=CC=C3NC(=O)C4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C=C(N2)CSC3=CC=CC=C3NC(=O)C4=CC(=CC=C4)Br)C

InChI

InChI=1S/C25H21BrN2O2S/c1-15-10-16(2)24-20(11-15)22(29)13-19(27-24)14-31-23-9-4-3-8-21(23)28-25(30)17-6-5-7-18(26)12-17/h3-13H,14H2,1-2H3,(H,27,29)(H,28,30)