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

Systemtic Name: 4-(azepan-1-yl)-3-[(E)-3-(furan-2-yl)prop-2-enyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-3-[(E)-3-(2-furyl)allyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-3-[(E)-3-(2-furanyl)prop-2-enyl]-N-methyl-N-(2-pyrrolidinyl)-4H-pyrimidin-2-amine IUPAC Name: 4-(azepan-1-yl)-3-[(E)-3-(furan-2-yl)prop-2-enyl]-N-methyl-N-pyrrolidin-2-yl-4H-pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)-3-[(E)-3-(2-furyl)allyl]-4H-pyrimidin-2-yl]-methyl-pyrrolidin-2-yl-amine Formula: C22H33N5O MolecularWeight: 383.53032

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCN1)C2=NC=CC(N2CC=CC3=CC=CO3)N4CCCCCC4

Isomeric SMILES

CN(C1CCCN1)C2=NC=CC(N2C/C=C/C3=CC=CO3)N4CCCCCC4

InChI

InChI=1S/C22H33N5O/c1-25(20-11-6-13-23-20)22-24-14-12-21(26-15-4-2-3-5-16-26)27(22)17-7-9-19-10-8-18-28-19/h7-10,12,14,18,20-21,23H,2-6,11,13,15-17H2,1H3/b9-7+