2-[(2-tert-butylphenyl)amino]pyrimido[2,1-a]isoquinolin-4-one

Systemtic Name: 2-[(2-tert-butylphenyl)amino]pyrimido[2,1-a]isoquinolin-4-one Openeye Name: 2-(2-tert-butylanilino)pyrimido[2,1-a]isoquinolin-4-one CAS Name: 2-(2-tert-butylanilino)-4-pyrimido[2,1-a]isoquinolinone IUPAC Name: 2-(2-tert-butylanilino)pyrimido[2,1-a]isoquinolin-4-one Traditional Name: 2-(2-tert-butylanilino)pyrimid[2,1-a]isoquinolin-4-one Formula: C22H21N3O MolecularWeight: 343.42164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC2=CC(=O)N3C=CC4=CC=CC=C4C3=N2

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC2=CC(=O)N3C=CC4=CC=CC=C4C3=N2

InChI

InChI=1S/C22H21N3O/c1-22(2,3)17-10-6-7-11-18(17)23-19-14-20(26)25-13-12-15-8-4-5-9-16(15)21(25)24-19/h4-14,23H,1-3H3