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N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]quinoline-2-carboxamide
N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]quinoline-2-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=NC4=CC=CC=C4C=C3
Isomeric SMILES
C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=NC4=CC=CC=C4C=C3
InChI
InChI=1S/C22H25N5O2/c28-22(19-10-9-17-7-3-4-8-18(17)26-19)23-11-14-29-21-15-20(24-16-25-21)27-12-5-1-2-6-13-27/h3-4,7-10,15-16H,1-2,5-6,11-14H2,(H,23,28)
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