N-[(2S)-1-(1H-imidazol-5-yl)-3-(2-methylidenecyclohexyl)oxy-propan-2-yl]-4-naphthalen-2-yl-pyrimidin-2-amine

Systemtic Name: N-[(2S)-1-(1H-imidazol-5-yl)-3-(2-methylidenecyclohexyl)oxy-propan-2-yl]-4-naphthalen-2-yl-pyrimidin-2-amine Openeye Name: N-[(1S)-1-(1H-imidazol-5-ylmethyl)-2-(2-methylenecyclohexoxy)ethyl]-4-(2-naphthyl)pyrimidin-2-amine CAS Name: N-[(2S)-1-(1H-imidazol-5-yl)-3-(2-methylenecyclohexyl)oxypropan-2-yl]-4-(2-naphthalenyl)-2-pyrimidinamine IUPAC Name: N-[(2S)-1-(1H-imidazol-5-yl)-3-(2-methylidenecyclohexyl)oxypropan-2-yl]-4-naphthalen-2-ylpyrimidin-2-amine Traditional Name: [(1S)-1-(1H-imidazol-5-ylmethyl)-2-(2-methylenecyclohexoxy)ethyl]-[4-(2-naphthyl)pyrimidin-2-yl]amine Formula: C27H29N5O MolecularWeight: 439.55206

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CCCCC1OCC(CC2=CN=CN2)NC3=NC=CC(=N3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C=C1CCCCC1OC[C@H](CC2=CN=CN2)NC3=NC=CC(=N3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H29N5O/c1-19-6-2-5-9-26(19)33-17-24(15-23-16-28-18-30-23)31-27-29-13-12-25(32-27)22-11-10-20-7-3-4-8-21(20)14-22/h3-4,7-8,10-14,16,18,24,26H,1-2,5-6,9,15,17H2,(H,28,30)(H,29,31,32)/t24-,26?/m0/s1