4-(methoxymethyl)-6-methyl-2-[(phenylmethyl)amino]-5-pyrrol-1-yl-pyridine-3-carbonitrile

Systemtic Name: 4-(methoxymethyl)-6-methyl-2-[(phenylmethyl)amino]-5-pyrrol-1-yl-pyridine-3-carbonitrile Openeye Name: 2-(benzylamino)-4-(methoxymethyl)-6-methyl-5-pyrrol-1-yl-pyridine-3-carbonitrile CAS Name: 4-(methoxymethyl)-6-methyl-2-[(phenylmethyl)amino]-5-(1-pyrrolyl)-3-pyridinecarbonitrile IUPAC Name: 2-(benzylamino)-4-(methoxymethyl)-6-methyl-5-pyrrol-1-ylpyridine-3-carbonitrile Traditional Name: 2-(benzylamino)-4-(methoxymethyl)-6-methyl-5-pyrrol-1-yl-nicotinonitrile Formula: C20H20N4O MolecularWeight: 332.399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)NCC2=CC=CC=C2)C#N)COC)N3C=CC=C3

Isomeric SMILES

CC1=C(C(=C(C(=N1)NCC2=CC=CC=C2)C#N)COC)N3C=CC=C3

InChI

InChI=1S/C20H20N4O/c1-15-19(24-10-6-7-11-24)18(14-25-2)17(12-21)20(23-15)22-13-16-8-4-3-5-9-16/h3-11H,13-14H2,1-2H3,(H,22,23)