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

Systemtic Name: 5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline Openeye Name: 5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline CAS Name: 5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline IUPAC Name: 5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline Traditional Name: 5-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]isoquinoline Formula: C15H19N3O2S MolecularWeight: 305.39526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CN1CCCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C15H19N3O2S/c1-17-8-3-9-18(11-10-17)21(19,20)15-5-2-4-13-12-16-7-6-14(13)15/h2,4-7,12H,3,8-11H2,1H3