1-(4-bromophenyl)-3-ethyl-3-(4-methylphenyl)sulfonyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea

Systemtic Name: 1-(4-bromophenyl)-3-ethyl-3-(4-methylphenyl)sulfonyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Openeye Name: 1-(4-bromophenyl)-3-ethyl-3-(p-tolylsulfonyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea CAS Name: 1-(4-bromophenyl)-3-ethyl-3-(4-methylphenyl)sulfonyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea IUPAC Name: 1-(4-bromophenyl)-3-ethyl-3-(4-methylphenyl)sulfonyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Traditional Name: 1-(4-bromophenyl)-3-ethyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-3-tosyl-urea Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)N(C1=NCCCCC1)C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN(C(=O)N(C1=NCCCCC1)C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26BrN3O3S/c1-3-25(30(28,29)20-14-8-17(2)9-15-20)22(27)26(19-12-10-18(23)11-13-19)21-7-5-4-6-16-24-21/h8-15H,3-7,16H2,1-2H3