5-bromanyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[4-(2,4,5-trimethylphenyl)-2-thiazolyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]nicotinamide Formula: C18H16BrN3OS MolecularWeight: 402.30814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=CC(=CN=C3)Br)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=CC(=CN=C3)Br)C)C

InChI

InChI=1S/C18H16BrN3OS/c1-10-4-12(3)15(5-11(10)2)16-9-24-18(21-16)22-17(23)13-6-14(19)8-20-7-13/h4-9H,1-3H3,(H,21,22,23)