4-fluoranyl-5-[(2-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline

Systemtic Name: 4-fluoranyl-5-[(2-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline Openeye Name: 4-fluoro-5-[(2-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline CAS Name: 4-fluoro-5-[(2-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline IUPAC Name: 4-fluoro-5-[(2-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline Traditional Name: 4-fluoro-5-[(2-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline Formula: C15H18FN3O2S MolecularWeight: 323.385723

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCCN1S(=O)(=O)C2=CC=CC3=CN=CC(=C32)F

Isomeric SMILES

CC1CNCCCN1S(=O)(=O)C2=CC=CC3=CN=CC(=C32)F

InChI

InChI=1S/C15H18FN3O2S/c1-11-8-17-6-3-7-19(11)22(20,21)14-5-2-4-12-9-18-10-13(16)15(12)14/h2,4-5,9-11,17H,3,6-8H2,1H3