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

Systemtic Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-5-bromanyl-pyridine-3-carboxamide Openeye Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-5-bromo-pyridine-3-carboxamide CAS Name: N-[4-[4-(2-acetamidoethyl)phenyl]-2-thiazolyl]-5-bromo-3-pyridinecarboxamide IUPAC Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-5-bromopyridine-3-carboxamide Traditional Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-5-bromo-nicotinamide Formula: C19H17BrN4O2S MolecularWeight: 445.33288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C19H17BrN4O2S/c1-12(25)22-7-6-13-2-4-14(5-3-13)17-11-27-19(23-17)24-18(26)15-8-16(20)10-21-9-15/h2-5,8-11H,6-7H2,1H3,(H,22,25)(H,23,24,26)