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4-(azepan-1-yl)-N-[1-[(3-phenylmethoxyphenyl)methyl]piperidin-3-yl]pyrimidin-2-amine
4-(azepan-1-yl)-N-[1-[(3-phenylmethoxyphenyl)methyl]piperidin-3-yl]pyrimidin-2-amine
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Descriptors Computed from Structure
Canonical SMILES:
C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCN(C3)CC4=CC(=CC=C4)OCC5=CC=CC=C5
Isomeric SMILES
C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCN(C3)CC4=CC(=CC=C4)OCC5=CC=CC=C5
InChI
InChI=1S/C29H37N5O/c1-2-7-19-34(18-6-1)28-15-16-30-29(32-28)31-26-13-9-17-33(22-26)21-25-12-8-14-27(20-25)35-23-24-10-4-3-5-11-24/h3-5,8,10-12,14-16,20,26H,1-2,6-7,9,13,17-19,21-23H2,(H,30,31,32)
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