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N-[2-[3-[4-(aminomethyl)phenyl]propylamino]ethyl]-1-benzothiophene-5-sulfonamide
N-[2-[3-[4-(aminomethyl)phenyl]propylamino]ethyl]-1-benzothiophene-5-sulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1CCCNCCNS(=O)(=O)C2=CC3=C(C=C2)SC=C3)CN
Isomeric SMILES
C1=CC(=CC=C1CCCNCCNS(=O)(=O)C2=CC3=C(C=C2)SC=C3)CN
InChI
InChI=1S/C20H25N3O2S2/c21-15-17-5-3-16(4-6-17)2-1-10-22-11-12-23-27(24,25)19-7-8-20-18(14-19)9-13-26-20/h3-9,13-14,22-23H,1-2,10-12,15,21H2
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