N-[4-bromanyl-2-[[(E)-(3,4-dimethylphenyl)methylideneamino]carbamoyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-bromanyl-2-[[(E)-(3,4-dimethylphenyl)methylideneamino]carbamoyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-bromo-2-[[(E)-(3,4-dimethylphenyl)methyleneamino]carbamoyl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-bromo-2-[[(2E)-2-[(3,4-dimethylphenyl)methylidene]hydrazinyl]-oxomethyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-bromo-2-[[(E)-(3,4-dimethylphenyl)methylideneamino]carbamoyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-bromo-2-[[(E)-(3,4-dimethylbenzylidene)amino]carbamoyl]phenyl]nicotinamide Formula: C22H19BrN4O2 MolecularWeight: 451.31586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=NNC(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CN=CC=C3)C

InChI

InChI=1S/C22H19BrN4O2/c1-14-5-6-16(10-15(14)2)12-25-27-22(29)19-11-18(23)7-8-20(19)26-21(28)17-4-3-9-24-13-17/h3-13H,1-2H3,(H,26,28)(H,27,29)/b25-12+