1-chloranyl-3-[2-[cyclohexyl(methyl)amino]ethyl]isoquinoline-5-sulfonamide

Systemtic Name: 1-chloranyl-3-[2-[cyclohexyl(methyl)amino]ethyl]isoquinoline-5-sulfonamide Openeye Name: 1-chloro-3-[2-[cyclohexyl(methyl)amino]ethyl]isoquinoline-5-sulfonamide CAS Name: 1-chloro-3-[2-[cyclohexyl(methyl)amino]ethyl]-5-isoquinolinesulfonamide IUPAC Name: 1-chloro-3-[2-[cyclohexyl(methyl)amino]ethyl]isoquinoline-5-sulfonamide Traditional Name: 1-chloro-3-[2-[cyclohexyl(methyl)amino]ethyl]isoquinoline-5-sulfonamide Formula: C18H24ClN3O2S MolecularWeight: 381.92006

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=NC(=C2C=CC=C(C2=C1)S(=O)(=O)N)Cl)C3CCCCC3

Isomeric SMILES

CN(CCC1=NC(=C2C=CC=C(C2=C1)S(=O)(=O)N)Cl)C3CCCCC3

InChI

InChI=1S/C18H24ClN3O2S/c1-22(14-6-3-2-4-7-14)11-10-13-12-16-15(18(19)21-13)8-5-9-17(16)25(20,23)24/h5,8-9,12,14H,2-4,6-7,10-11H2,1H3,(H2,20,23,24)