5-(3-ethenylphenyl)-3-methyl-2-[2-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 5-(3-ethenylphenyl)-3-methyl-2-[2-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[2-[(isopropylamino)methyl]pyrrolidin-1-yl]-3-methyl-6-(4-pyridyl)-5-(3-vinylphenyl)pyrimidin-4-one CAS Name: 5-(3-ethenylphenyl)-3-methyl-2-[2-[(propan-2-ylamino)methyl]-1-pyrrolidinyl]-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 5-(3-ethenylphenyl)-3-methyl-2-[2-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[2-[(isopropylamino)methyl]pyrrolidino]-3-methyl-6-(4-pyridyl)-5-(3-vinylphenyl)pyrimidin-4-one Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1CCCN1C2=NC(=C(C(=O)N2C)C3=CC(=CC=C3)C=C)C4=CC=NC=C4

Isomeric SMILES

CC(C)NCC1CCCN1C2=NC(=C(C(=O)N2C)C3=CC(=CC=C3)C=C)C4=CC=NC=C4

InChI

InChI=1S/C26H31N5O/c1-5-19-8-6-9-21(16-19)23-24(20-11-13-27-14-12-20)29-26(30(4)25(23)32)31-15-7-10-22(31)17-28-18(2)3/h5-6,8-9,11-14,16,18,22,28H,1,7,10,15,17H2,2-4H3