1-[[6-chloranyl-5-(hydroxymethyl)pyridin-3-yl]methyl]-4-(3-cyanophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile

Systemtic Name: 1-[[6-chloranyl-5-(hydroxymethyl)pyridin-3-yl]methyl]-4-(3-cyanophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile Openeye Name: 1-[[6-chloro-5-(hydroxymethyl)-3-pyridyl]methyl]-4-(3-cyanophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile CAS Name: 1-[[6-chloro-5-(hydroxymethyl)-3-pyridinyl]methyl]-4-(3-cyanophenyl)-2,5-dimethyl-3-pyrrolecarbonitrile IUPAC Name: 1-[[6-chloro-5-(hydroxymethyl)pyridin-3-yl]methyl]-4-(3-cyanophenyl)-2,5-dimethylpyrrole-3-carbonitrile Traditional Name: 1-[(6-chloro-5-methylol-3-pyridyl)methyl]-4-(3-cyanophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile Formula: C21H17ClN4O MolecularWeight: 376.83888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC(=C(N=C2)Cl)CO)C)C3=CC=CC(=C3)C#N)C#N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC(=C(N=C2)Cl)CO)C)C3=CC=CC(=C3)C#N)C#N

InChI

InChI=1S/C21H17ClN4O/c1-13-19(9-24)20(17-5-3-4-15(6-17)8-23)14(2)26(13)11-16-7-18(12-27)21(22)25-10-16/h3-7,10,27H,11-12H2,1-2H3