7-[(4-ethylphenyl)amino]-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(4-ethylphenyl)amino]-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 6-benzyl-7-(4-ethylanilino)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(4-ethylanilino)-6-(phenylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 6-benzyl-7-(4-ethylanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 6-benzyl-7-(4-ethylanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C22H21N3O MolecularWeight: 343.42164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O/c1-2-16-10-12-18(13-11-16)24-21-20-19(9-6-14-23-20)22(26)25(21)15-17-7-4-3-5-8-17/h3-14,21,24H,2,15H2,1H3