4-methyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-3-pyrrol-1-yl-benzamide

Systemtic Name: 4-methyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-3-pyrrol-1-yl-benzamide Openeye Name: 4-methyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]-3-pyrrol-1-yl-benzamide CAS Name: 4-methyl-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-3-(1-pyrrolyl)benzamide IUPAC Name: 4-methyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-3-pyrrol-1-ylbenzamide Traditional Name: 4-methyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]-3-pyrrol-1-yl-benzamide Formula: C25H19N3O MolecularWeight: 377.43786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)N4C=CC=C4

InChI

InChI=1S/C25H19N3O/c1-19-10-12-21(18-24(19)28-15-4-5-16-28)25(29)27-23-9-6-7-20(17-23)11-13-22-8-2-3-14-26-22/h2-10,12,14-18H,1H3,(H,27,29)