4-(azepan-1-yl)-N-[(E)-but-2-enyl]-2-methyl-N-pyrrolidin-3-yl-pyrimidin-5-amine

Systemtic Name: 4-(azepan-1-yl)-N-[(E)-but-2-enyl]-2-methyl-N-pyrrolidin-3-yl-pyrimidin-5-amine Openeye Name: 4-(azepan-1-yl)-N-[(E)-but-2-enyl]-2-methyl-N-pyrrolidin-3-yl-pyrimidin-5-amine CAS Name: 4-(1-azepanyl)-N-[(E)-but-2-enyl]-2-methyl-N-(3-pyrrolidinyl)-5-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[(E)-but-2-enyl]-2-methyl-N-pyrrolidin-3-ylpyrimidin-5-amine Traditional Name: [4-(azepan-1-yl)-2-methyl-pyrimidin-5-yl]-[(E)-but-2-enyl]-pyrrolidin-3-yl-amine Formula: C19H31N5 MolecularWeight: 329.48294

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCN(C1CCNC1)C2=CN=C(N=C2N3CCCCCC3)C

Isomeric SMILES

C/C=C/CN(C1CCNC1)C2=CN=C(N=C2N3CCCCCC3)C

InChI

InChI=1S/C19H31N5/c1-3-4-13-24(17-9-10-20-14-17)18-15-21-16(2)22-19(18)23-11-7-5-6-8-12-23/h3-4,15,17,20H,5-14H2,1-2H3/b4-3+