4-(azepan-1-yl)-3-[2-methyl-3-(4-propan-2-ylphenyl)propyl]-N-pyrrolidin-3-yl-4H-pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-3-[2-methyl-3-(4-propan-2-ylphenyl)propyl]-N-pyrrolidin-3-yl-4H-pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-3-[3-(4-isopropylphenyl)-2-methyl-propyl]-N-pyrrolidin-3-yl-4H-pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-3-[2-methyl-3-(4-propan-2-ylphenyl)propyl]-N-(3-pyrrolidinyl)-4H-pyrimidin-2-amine IUPAC Name: 4-(azepan-1-yl)-3-[2-methyl-3-(4-propan-2-ylphenyl)propyl]-N-pyrrolidin-3-yl-4H-pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)-3-(2-methyl-3-p-cumenyl-propyl)-4H-pyrimidin-2-yl]-pyrrolidin-3-yl-amine Formula: C27H43N5 MolecularWeight: 437.66382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC(C)CN2C(C=CN=C2NC3CCNC3)N4CCCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC(C)CN2C(C=CN=C2NC3CCNC3)N4CCCCCC4

InChI

InChI=1S/C27H43N5/c1-21(2)24-10-8-23(9-11-24)18-22(3)20-32-26(31-16-6-4-5-7-17-31)13-15-29-27(32)30-25-12-14-28-19-25/h8-11,13,15,21-22,25-26,28H,4-7,12,14,16-20H2,1-3H3,(H,29,30)