N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-chloranyl-pyridine-3-carboxamide Openeye Name: 2-chloro-N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]pyridine-3-carboxamide CAS Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-chloro-3-pyridinecarboxamide IUPAC Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-chloropyridine-3-carboxamide Traditional Name: 2-chloro-N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]nicotinamide Formula: C23H20ClN3O2 MolecularWeight: 405.8768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=C(N=CC=C4)Cl

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=C(N=CC=C4)Cl

InChI

InChI=1S/C23H20ClN3O2/c1-3-14(2)16-8-11-20-19(13-16)27-23(29-20)15-6-9-17(10-7-15)26-22(28)18-5-4-12-25-21(18)24/h4-14H,3H2,1-2H3,(H,26,28)