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2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(phenylmethyl)ethanamide
2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(phenylmethyl)ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
C1CCCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=CC=C4
Isomeric SMILES
C1CCCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=CC=C4
InChI
InChI=1S/C24H25N5O/c25-16-19(24(30)26-17-18-10-4-3-5-11-18)22-23(29-14-8-1-2-9-15-29)28-21-13-7-6-12-20(21)27-22/h3-7,10-13,19H,1-2,8-9,14-15,17H2,(H,26,30)
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