N-[(E)-[4-bromanyl-1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[4-bromanyl-1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]pyridine-4-carboxamide Openeye Name: N-[(E)-[4-bromo-1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]pyridine-4-carboxamide CAS Name: N-[(E)-[4-bromo-1-(3,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[4-bromo-1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-[4-bromo-1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]isonicotinamide Formula: C21H21BrN4O MolecularWeight: 425.32164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(=C2C)Br)C=NNC(=O)C3=CC=NC=C3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C(=C2C)Br)/C=N/NC(=O)C3=CC=NC=C3)C)C

InChI

InChI=1S/C21H21BrN4O/c1-13-5-6-18(11-14(13)2)26-15(3)19(20(22)16(26)4)12-24-25-21(27)17-7-9-23-10-8-17/h5-12H,1-4H3,(H,25,27)/b24-12+