N-ethyl-N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]ethanamide

Systemtic Name: N-ethyl-N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]ethanamide Openeye Name: N-ethyl-N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide CAS Name: N-ethyl-N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide IUPAC Name: N-ethyl-N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide Traditional Name: N-ethyl-N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC(=C3)F)C(=O)C

Isomeric SMILES

CCN(C1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC(=C3)F)C(=O)C

InChI

InChI=1S/C22H28FN3O3S/c1-4-26(17(2)27)21-16-19(25-12-6-11-24(3)13-14-25)9-10-22(21)30(28,29)20-8-5-7-18(23)15-20/h5,7-10,15-16H,4,6,11-14H2,1-3H3