2-(6-bromanyl-2-methyl-quinolin-4-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-(6-bromanyl-2-methyl-quinolin-4-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-[(6-bromo-2-methyl-4-quinolyl)sulfanyl]-N-[(E)-(4-nitrophenyl)methyleneamino]acetamide CAS Name: 2-[(6-bromo-2-methyl-4-quinolinyl)thio]-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(6-bromo-2-methylquinolin-4-yl)sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-[(6-bromo-2-methyl-4-quinolyl)thio]-N-[(E)-(4-nitrobenzylidene)amino]acetamide Formula: C19H15BrN4O3S MolecularWeight: 459.3164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)SCC(=O)NN=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)SCC(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15BrN4O3S/c1-12-8-18(16-9-14(20)4-7-17(16)22-12)28-11-19(25)23-21-10-13-2-5-15(6-3-13)24(26)27/h2-10H,11H2,1H3,(H,23,25)/b21-10+