1-[(2,4-dichlorophenyl)methyl]-4-methylsulfonyl-1,4-diazepane

Systemtic Name: 1-[(2,4-dichlorophenyl)methyl]-4-methylsulfonyl-1,4-diazepane Openeye Name: 1-[(2,4-dichlorophenyl)methyl]-4-methylsulfonyl-1,4-diazepane CAS Name: 1-[(2,4-dichlorophenyl)methyl]-4-methylsulfonyl-1,4-diazepane IUPAC Name: 1-[(2,4-dichlorophenyl)methyl]-4-methylsulfonyl-1,4-diazepane Traditional Name: 1-(2,4-dichlorobenzyl)-4-mesyl-1,4-diazepane Formula: C13H18Cl2N2O2S MolecularWeight: 337.26522

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)CC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H18Cl2N2O2S/c1-20(18,19)17-6-2-5-16(7-8-17)10-11-3-4-12(14)9-13(11)15/h3-4,9H,2,5-8,10H2,1H3