5-(1,4-diazepan-1-yl)-2-(3-fluorophenyl)sulfonyl-aniline

Systemtic Name: 5-(1,4-diazepan-1-yl)-2-(3-fluorophenyl)sulfonyl-aniline Openeye Name: 5-(1,4-diazepan-1-yl)-2-(3-fluorophenyl)sulfonyl-aniline CAS Name: 5-(1,4-diazepan-1-yl)-2-(3-fluorophenyl)sulfonylaniline IUPAC Name: 5-(1,4-diazepan-1-yl)-2-(3-fluorophenyl)sulfonylaniline Traditional Name: [5-(1,4-diazepan-1-yl)-2-(3-fluorophenyl)sulfonyl-phenyl]amine Formula: C17H20FN3O2S MolecularWeight: 349.423003

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC(=C3)F)N

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC(=C3)F)N

InChI

InChI=1S/C17H20FN3O2S/c18-13-3-1-4-15(11-13)24(22,23)17-6-5-14(12-16(17)19)21-9-2-7-20-8-10-21/h1,3-6,11-12,20H,2,7-10,19H2