[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-[1-(4-phenylazanylpyrimidin-2-yl)piperidin-4-yl]methanone

Systemtic Name: [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-[1-(4-phenylazanylpyrimidin-2-yl)piperidin-4-yl]methanone Openeye Name: [1-(4-anilinopyrimidin-2-yl)-4-piperidyl]-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methanone CAS Name: [1-(4-anilino-2-pyrimidinyl)-4-piperidinyl]-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]methanone IUPAC Name: [1-(4-anilinopyrimidin-2-yl)piperidin-4-yl]-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methanone Traditional Name: [1-(4-anilinopyrimidin-2-yl)-4-piperidyl]-[(2S)-2-(methoxymethyl)pyrrolidino]methanone Formula: C22H29N5O2 MolecularWeight: 395.49796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1C(=O)C2CCN(CC2)C3=NC=CC(=N3)NC4=CC=CC=C4

Isomeric SMILES

COC[C@@H]1CCCN1C(=O)C2CCN(CC2)C3=NC=CC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C22H29N5O2/c1-29-16-19-8-5-13-27(19)21(28)17-10-14-26(15-11-17)22-23-12-9-20(25-22)24-18-6-3-2-4-7-18/h2-4,6-7,9,12,17,19H,5,8,10-11,13-16H2,1H3,(H,23,24,25)/t19-/m0/s1