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6-[4-[(3-phenylpropylamino)methyl]phenyl]sulfanylpyridine-3-carboxamide
6-[4-[(3-phenylpropylamino)methyl]phenyl]sulfanylpyridine-3-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C(C=C1)CCCNCC2=CC=C(C=C2)SC3=NC=C(C=C3)C(=O)N
Isomeric SMILES
C1=CC=C(C=C1)CCCNCC2=CC=C(C=C2)SC3=NC=C(C=C3)C(=O)N
InChI
InChI=1S/C22H23N3OS/c23-22(26)19-10-13-21(25-16-19)27-20-11-8-18(9-12-20)15-24-14-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-13,16,24H,4,7,14-15H2,(H2,23,26)
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