1-(3,4-dimethylphenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(p-tolylmethyl)-1,4-diazepane CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(4-methylbenzyl)-1,4-diazepane Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H28N2O2S/c1-17-5-8-20(9-6-17)16-22-11-4-12-23(14-13-22)26(24,25)21-10-7-18(2)19(3)15-21/h5-10,15H,4,11-14,16H2,1-3H3