1-(5-bromanylthiophen-2-yl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-4-(p-tolylmethyl)-1,4-diazepane CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-4-[(4-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-4-(4-methylbenzyl)-1,4-diazepane Formula: C17H21BrN2O2S2 MolecularWeight: 429.39484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H21BrN2O2S2/c1-14-3-5-15(6-4-14)13-19-9-2-10-20(12-11-19)24(21,22)17-8-7-16(18)23-17/h3-8H,2,9-13H2,1H3