4-(azepan-1-yl)-3-[(E)-3-(4-dimethylaminophenyl)prop-2-enyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-3-[(E)-3-(4-dimethylaminophenyl)prop-2-enyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-3-[(E)-3-(4-dimethylaminophenyl)allyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-3-[(E)-3-(4-dimethylaminophenyl)prop-2-enyl]-N-methyl-N-(2-pyrrolidinyl)-4H-pyrimidin-2-amine IUPAC Name: 4-(azepan-1-yl)-3-[(E)-3-(4-dimethylaminophenyl)prop-2-enyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)-3-[(E)-3-(4-dimethylaminophenyl)allyl]-4H-pyrimidin-2-yl]-methyl-pyrrolidin-2-yl-amine Formula: C26H40N6 MolecularWeight: 436.636

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CCN2C(C=CN=C2N(C)C3CCCN3)N4CCCCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/CN2C(C=CN=C2N(C)C3CCCN3)N4CCCCCC4

InChI

InChI=1S/C26H40N6/c1-29(2)23-14-12-22(13-15-23)10-9-21-32-25(31-19-6-4-5-7-20-31)16-18-28-26(32)30(3)24-11-8-17-27-24/h9-10,12-16,18,24-25,27H,4-8,11,17,19-21H2,1-3H3/b10-9+