4-[3-(2,5-dimethylpyrrol-1-yl)pyridin-2-yl]-N-(3-methylbutyl)benzamide

Systemtic Name: 4-[3-(2,5-dimethylpyrrol-1-yl)pyridin-2-yl]-N-(3-methylbutyl)benzamide Openeye Name: 4-[3-(2,5-dimethylpyrrol-1-yl)-2-pyridyl]-N-isopentyl-benzamide CAS Name: 4-[3-(2,5-dimethyl-1-pyrrolyl)-2-pyridinyl]-N-(3-methylbutyl)benzamide IUPAC Name: 4-[3-(2,5-dimethylpyrrol-1-yl)pyridin-2-yl]-N-(3-methylbutyl)benzamide Traditional Name: 4-[3-(2,5-dimethylpyrrol-1-yl)-2-pyridyl]-N-isoamyl-benzamide Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(N=CC=C2)C3=CC=C(C=C3)C(=O)NCCC(C)C)C

Isomeric SMILES

CC1=CC=C(N1C2=C(N=CC=C2)C3=CC=C(C=C3)C(=O)NCCC(C)C)C

InChI

InChI=1S/C23H27N3O/c1-16(2)13-15-25-23(27)20-11-9-19(10-12-20)22-21(6-5-14-24-22)26-17(3)7-8-18(26)4/h5-12,14,16H,13,15H2,1-4H3,(H,25,27)