3,4-dihydro-1H-isoquinolin-2-yl-[(2S)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidin-2-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[(2S)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidin-2-yl]methanone Openeye Name: [(2S)-1-(4-anilinopyrimidin-2-yl)pyrrolidin-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [(2S)-1-(4-anilino-2-pyrimidinyl)-2-pyrrolidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [(2S)-1-(4-anilinopyrimidin-2-yl)pyrrolidin-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [(2S)-1-(4-anilinopyrimidin-2-yl)pyrrolidin-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1C[C@H](N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H25N5O/c30-23(28-16-13-18-7-4-5-8-19(18)17-28)21-11-6-15-29(21)24-25-14-12-22(27-24)26-20-9-2-1-3-10-20/h1-5,7-10,12,14,21H,6,11,13,15-17H2,(H,25,26,27)/t21-/m0/s1