1-[(3-fluorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-[(3-fluorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-1,4-diazepane Openeye Name: 1-[(3-fluorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-1,4-diazepane CAS Name: 1-[(3-fluorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-[(3-fluorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-(3-fluorobenzyl)-4-(4-methoxyphenyl)sulfonyl-1,4-diazepane Formula: C19H23FN2O3S MolecularWeight: 378.460923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC(=CC=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C19H23FN2O3S/c1-25-18-6-8-19(9-7-18)26(23,24)22-11-3-10-21(12-13-22)15-16-4-2-5-17(20)14-16/h2,4-9,14H,3,10-13,15H2,1H3