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N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-(pyrimidin-2-ylamino)benzamide
N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-(pyrimidin-2-ylamino)benzamide
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Descriptors Computed from Structure
Canonical SMILES:
C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3
Isomeric SMILES
C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3
InChI
InChI=1S/C20H25N5O2/c26-18-9-2-1-3-13-25(18)14-6-12-21-19(27)16-7-4-8-17(15-16)24-20-22-10-5-11-23-20/h4-5,7-8,10-11,15H,1-3,6,9,12-14H2,(H,21,27)(H,22,23,24)
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